EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
BT
 

heliotropyl acetone
dulcinyl (IFF)

Sponsors

Fragrance Demo Formulas
Name:4-(1,3-benzodioxol-5-yl)butan-2-one
CAS Number: 55418-52-5Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:259-630-1
FDA UNII:081VVC9H34
Nikkaji Web:J55.487A
MDL:MFCD00016910
CoE Number:165
XlogP3:1.80 (est)
Molecular Weight:192.21424000
Formula:C11 H12 O3
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
Category:flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
JECFA Food Flavoring:2048 4-(3,4-methylenedioxyphenyl)-2-butanone
Flavis Number:07.031 (Old)
DG SANTE Food Flavourings:07.031 piperonyl acetone
FEMA Number:2701 piperonal acetone
FDA Mainterm: 4-(3,4-METHYLENEDIOXYPHENYL)-2-BUTANONE
 
Physical Properties:
Appearance:off-white to pale brown crystalline powder (est)
Assay: 99.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: 47.00 to 54.00 °C. @ 760.00 mm Hg
Boiling Point: 176.00 °C. @ 17.00 mm Hg
Vapor Pressure:0.002000 mm/Hg @ 25.00 °C. (est)
Flash Point:> 230.00 °F. TCC ( > 110.00 °C. )
logP (o/w): 1.148
Shelf Life: 36.00 month(s) or longer if stored properly.
Storage:store in cool, dry place in tightly sealed containers, protected from heat and light.
Soluble in:
 alcohol
 water, 892.1 mg/L @ 25 °C (est)
Insoluble in:
 water
Stability:
 acid cleaner
 alcoholic lotion
 antiperspirant
 deo stick
 detergent
 fabric softener
 hard surface cleaner
 shampoo
 soap
 vleach
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
Substantivity:400 hour(s) at 100.00 %
sweet raspberry heliotrope powdery cotton candy
Odor Description:at 10.00 % in dipropylene glycol. sweet raspberry heliotrope powdery cotton candy
Luebke, William tgsc, (1991)
sweet powdery floral berry fruity jammy
Odor Description:Sweet, powdery, floral, berry and fruity with a jammy nuance
Mosciano, Gerard P&F 20, No. 2, 37, (1995)
Flavor Type: berry
sweet berry spicy jammy
Taste Description: at 40.00 ppm. Sweet, berry-like with spicy, jammy nuances
Mosciano, Gerard P&F 20, No. 2, 37, (1995)
Odor and/or flavor descriptions from others (if found).
IFF
Dulcinyl® Recrystallized
Odor Description:Extremely sweet odor reminding of raspberry, cotton candy (i.e. candy floss), blackberry jam with cassis, heliotrope associations
Moellhausen
PIPERONYL ACETONE
Odor Description:sweet aromatic, floral-fruity, cassie and mimosa connotation
Taste Description:sweet aromatic, somewhat fruity on dilution; berry-like with spicy and jammy nuances
Indukern F&F
PIPERONYL ACETONE
Odor Description:STRAWBERRY, SWEET, FLORAL, METALIC
Taytonn
Dulcinyl® Recrystallized
Odor Description:Fruity, Heliotrope , Sweet
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
A.C.S. International
Heliotropinone
Operational Capabilities
Azelis UK
DULCINYL RECRYSTALLIZED
Services
BOC Sciences
For experimental / research use only.
4-(1,3-Benzodioxol-5-yl)-2-butanone
CG Herbals
Piperonyl Acetone
Creatingperfume.com
DULCINYL IFF
Odor: raspberry, cotton candy (i.e. candy floss), blackberry jam with cassis, heliotrope associations
Ernesto Ventós
PIPERONYL ACETONE
Odor: SWEET,RASPBERRY,COTTON CANDY,CASSIE
Frinton Laboratories
For experimental / research use only.
4-(3,4-Methylenedioxyphenyl)-2-butanone
Global Essence
Heliotropine Acetone
IFF
Dulcinyl® Recrystallized
Odor: Extremely sweet odor reminding of raspberry, cotton candy (i.e. candy floss), blackberry jam with cassis, heliotrope associations
Indukern F&F
PIPERONYL ACETONE
Odor: STRAWBERRY, SWEET, FLORAL, METALIC
Moellhausen
PIPERONYL ACETONE
Odor: sweet aromatic, floral-fruity, cassie and mimosa connotation
Flavor: sweet aromatic, somewhat fruity on dilution; berry-like with spicy and jammy nuances
PCAS
Heliotropine Acetone
Penta International
PIPERONYL ACETONE, Kosher
Reincke & Fichtner
Piperonyl Acetone
Santa Cruz Biotechnology
For experimental / research use only.
4-(3,4-Methylenedioxy)phenyl-2-butanone
Sigma-Aldrich: Aldrich
For experimental / research use only.
4-Benzo(1,3)dioxol-5-yl-butan-2-one
Taytonn
Dulcinyl® Recrystallized
Odor: Fruity, Heliotrope , Sweet
TCI AMERICA
For experimental / research use only.
Piperonylacetone >98.0%(GC)
The John D. Walsh Company
Dulcinyl Recrystallized
 
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-rat LD50 4000 mg/kg

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for heliotropyl acetone usage levels up to:
  15.0000 % in the fragrance concentrate.
 
Structure Class: III
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 3
 average usual ppmaverage maximum ppm
baked goods: -40.00000
beverages(nonalcoholic): -8.20000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -45.00000
fruit ices: -45.00000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -40.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
 
Safety References:
EPI System: View
EPA Substance Registry Services (TSCA):55418-52-5
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :62098
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
4-(1,3-benzodioxol-5-yl)butan-2-one
Chemidplus:0055418525
 
References:
 4-(1,3-benzodioxol-5-yl)butan-2-one
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:55418-52-5
Pubchem (cid):62098
Pubchem (sid):135019233
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Everything Added to Food in the United States (EAFUS):View
CHEMBL:View
HMDB (The Human Metabolome Database):HMDB41481
FooDB:FDB021444
Export Tariff Code:2914.19.0000
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
FAO:4-(3,4-Methylenedioxyphenyl)-2-butanone
 
Potential Blenders and core components note
For Odor
acidic
2-
methyl-2-pentenoic acid
FL/FR
aldehydic
citrus carbaldehyde
FR
nonanal (aldehyde C-9)
FL/FR
amber
ambroxan
FL/FR
cistus ladaniferus resinoid
FR
anise
anise seed oil colombia
FL/FR
anisic
para-
anisaldehyde
FL/FR
para-
anisyl propanal
FR
dihydroanethol
FL/FR
balsamic
iso
amyl benzoate
FL/FR
iso
amyl cinnamate
FL/FR
amyris wood oil
FL/FR
siam
benzoin resinoid
FL/FR
benzyl cinnamate
FL/FR
iso
butyl cinnamate
FL/FR
cinnamyl alcohol
FL/FR
clover nitrile
FR
conifer acetate
FR
ethyl cinnamate
FL/FR
fir balsam absolute
FR
methyl cinnamate
FL/FR
3-
phenyl propyl alcohol
FL/FR
berry
raspberry ketone
FL/FR
raspberry ketone acetate
FL/FR
raspberry ketone methyl ether
FL/FR
bready
coffee furanone
FL/FR
buttery
acetoin
FL/FR
acetyl butyryl
FL/FR
caramellic
cyclotene
FL/FR
ethyl maltol
FL/FR
immortelle absolute
FL/FR
maltol
FL/FR
maltyl isobutyrate
FL/FR
maltyl propionate
FL/FR
strawberry furanone
FL/FR
toffee furanone
FL/FR
chocolate
iso
amyl phenyl acetate
FL/FR
citrus
dihydromyrcenol
FL/FR
blood
orange oil italy
FL/FR
sweet
orange peel oil c.p. brazil
FL/FR
coconut
gamma-
heptalactone
FL/FR
gamma-
nonalactone (aldehyde C-18 (so-called))
FL/FR
gamma-
octalactone
FL/FR
ethereal
cyclohexyl formate
FL/FR
floral
acetophenone
FL/FR
benzyl isobutyrate
FL/FR
bois de rose oil brazil
FL/FR
cassis buteneone
FR
citronellol
FL/FR
para-
cresyl propionaldehyde
CS
cyclohexyl ethyl acetate
FL/FR
beta-
damascenone
FL/FR
delta-
damascone
FL/FR
alpha-
damascone
FL/FR
dihydro-alpha-ionone
FL/FR
dihydrojasmone
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
dimethyl benzyl carbinyl butyrate
FL/FR
ethyl ortho-anisate
FL/FR
ethyl phenyl acetate
FL/FR
floral pyranol
FR
geraniol
FL/FR
geranyl phenyl acetate
FL/FR
heliotrope absolute
FR
heliotropin
FL/FR
heliotropyl acetate
FL/FR
hyacinth ether
FR
alpha-
ionol
FL/FR
(E)-beta-
ionone
FL/FR
beta-
ionyl acetate
FL/FR
jasmin absolute (from chassis)
FL/FR
jasmin absolute egypt (from concrete)
FL/FR
jasmin absolute italy (from concrete)
FL/FR
linalool oxide
FL/FR
para-
methyl acetophenone
FL/FR
methyl dihydrojasmonate
FL/FR
beta-iso
methyl ionone
FL/FR
nonanol
FL/FR
ocean propanal
FL/FR
orris rhizome resinoid (iris pallida)
FL/FR
phenethyl acetate
FL/FR
phenethyl alcohol
FL/FR
phenethyl isobutyrate
FL/FR
phenethyl phenyl acetate
FL/FR
phenethyl propionate
FL/FR
4-
phenyl-2-butanol
FL/FR
rose butanoate
FL/FR
tetrahydrolinalool
FL/FR
fruity
allyl amyl glycolate
FR
iso
amyl butyrate
FL/FR
iso
amyl isovalerate
FL/FR
benzyl propionate
FL/FR
berry hexanoate
FR
iso
butyl isovalerate
FL/FR
butyl valerate
FL/FR
beta-
damascone
FL/FR
gamma-
decalactone
FL/FR
dimethyl benzyl carbinyl isobutyrate
FR
geranyl butyrate
FL/FR
green acetate
FR
heliotropyl isobutyrate
FL/FR
linalyl isobutyrate
FL/FR
neryl isobutyrate
FL/FR
neryl propionate
FL/FR
octyl propionate
FL/FR
3-
phenyl propyl isovalerate
FL/FR
prenyl acetate
FL/FR
propyl acetate
FL/FR
prune glycidate
FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
4-(para-
tolyl)-2-butanone
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
green
galbanum oil
FL/FR
(Z)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
hexyl 2-methyl butyrate
FL/FR
hay
beeswax absolute
FL/FR
hay absolute
FR
herbal
(S)-
campholene acetate
FL/FR
carum carvi fruit oil
FL/FR
clary sage oil france
FL/FR
herbal undecanone
FR
linalyl octanoate
FL/FR
honey
methyl phenyl acetate
FL/FR
phenyl acetic acid
FL/FR
licorice
(E)-
anethol
FL/FR
mossy
veramoss (IFF)
FR
musk
ethylene brassylate
FL/FR
naphthyl
beta-
naphthyl ethyl ether
FL/FR
popcorn
2-
acetyl pyrazine
FL/FR
2-
acetyl pyridine
FL/FR
powdery
para-
anisyl acetate
FL/FR
para-
anisyl alcohol
FL/FR
spicy
cassia bark oil china
FL/FR
clove bud oil
FL/FR
black
currant bud absolute
FL/FR
eugenol
FL/FR
iso
eugenyl acetate
FL/FR
alpha-
methyl cinnamaldehyde
FL/FR
methyl isoeugenol
FL/FR
myrtenal
FL/FR
terpenic
frankincense oil
FL/FR
tonka
coumarin
FR
gamma-
hexalactone
FL/FR
tonka bean absolute
FR
vanilla
ethyl vanillin
FL/FR
vanilla bean absolute (vanilla planifolia)
FL/FR
vanillyl acetate
FL/FR
waxy
decyl acetate
FL/FR
woody
guaiacwood oil
FL/FR
gurjun balsam oil
FR
santall
FR
tobacarol (IFF)
FR
woody acetate
FR
yeasty
2-
octen-4-one
FL/FR
For Flavor
No flavor group found for these
allyl 2-furoate
FL
ethyl ortho-anisate
FL/FR
beta-iso
methyl ionone
FL/FR
3-
phenyl propyl isovalerate
FL/FR
beta-
damascone
FL/FR
aldehydic
aldehydic
nonanal (aldehyde C-9)
FL/FR
anise
(E)-
anethol
FL/FR
anise seed oil colombia
FL/FR
balsamic
siam
benzoin resinoid
FL/FR
iso
butyl cinnamate
FL/FR
ethyl cinnamate
FL/FR
berry
dihydro-alpha-ionone
FL/FR
raspberry ketone
FL/FR
raspberry ketone acetate
FL/FR
raspberry ketone methyl ether
FL/FR
brown
beeswax absolute
FL/FR
caramellic
caramel furanone
FL
cyclotene
FL/FR
ethyl maltol
FL/FR
maltol
FL/FR
maltyl propionate
FL/FR
strawberry furanone
FL/FR
toffee furanone
FL/FR
cherry
heliotropin
FL/FR
citrus
blood
orange oil italy
FL/FR
sweet
orange peel oil c.p. brazil
FL/FR
coconut
6-
methyl coumarin
FL
gamma-
nonalactone (aldehyde C-18 (so-called))
FL/FR
corn
2-
acetyl pyridine
FL/FR
2-
acetyl-2-thiazoline
FL
creamy
acetoin
FL/FR
acetyl butyryl
FL/FR
para-
anisaldehyde
FL/FR
gamma-
hexalactone
FL/FR
para-
methyl acetophenone
FL/FR
gamma-
undecalactone (aldehyde C-14 (so-called))
FL/FR
estery
octyl propionate
FL/FR
propyl acetate
FL/FR
floral
iso
amyl cinnamate
FL/FR
iso
amyl phenyl acetate
FL/FR
bois de rose oil brazil
FL/FR
citronellol
FL/FR
dihydrojasmone
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
dimethyl benzyl carbinyl butyrate
FL/FR
geraniol
FL/FR
geranyl phenyl acetate
FL/FR
heliotropyl acetate
FL/FR
jasmin absolute (from chassis)
FL/FR
jasmin absolute egypt (from concrete)
FL/FR
jasmin absolute italy (from concrete)
FL/FR
linalyl isobutyrate
FL/FR
methyl dihydrojasmonate
FL/FR
methyl phenyl acetate
FL/FR
ocean propanal
FL/FR
orris rhizome resinoid (iris pallida)
FL/FR
phenethyl alcohol
FL/FR
phenethyl propionate
FL/FR
phenyl acetic acid
FL/FR
4-
phenyl-2-butanol
FL/FR
tetrahydrolinalool
FL/FR
fruity
iso
amyl benzoate
FL/FR
para-
anisyl acetate
FL/FR
para-
anisyl alcohol
FL/FR
benzyl isobutyrate
FL/FR
benzyl propionate
FL/FR
butyl valerate
FL/FR
alpha-
damascone
FL/FR
gamma-
decalactone
FL/FR
geranyl butyrate
FL/FR
heliotropyl isobutyrate
FL/FR
linalyl octanoate
FL/FR
neryl isobutyrate
FL/FR
prenyl acetate
FL/FR
rose butanoate
FL/FR
strawberry glycidate 1 (aldehyde C-16 (so-called))
FL/FR
4-(para-
tolyl)-2-butanone
FL/FR
green
iso
amyl isovalerate
FL/FR
iso
butyl isovalerate
FL/FR
cinnamyl alcohol
FL/FR
cyclohexyl ethyl acetate
FL/FR
cyclohexyl formate
FL/FR
dihydromyrcenol
FL/FR
galbanum oil
FL/FR
(Z)-3-
hexen-1-yl acetate
FL/FR
(Z)-3-
hexen-1-yl propionate
FL/FR
hexyl 2-methyl butyrate
FL/FR
immortelle absolute
FL/FR
linalool oxide
FL/FR
neryl propionate
FL/FR
herbal
carum carvi fruit oil
FL/FR
clary sage oil france
FL/FR
dihydroanethol
FL/FR
honey
ethyl phenyl acetate
FL/FR
phenethyl acetate
FL/FR
phenethyl isobutyrate
FL/FR
phenethyl phenyl acetate
FL/FR
jammy
(S)-
campholene acetate
FL/FR
maltyl isobutyrate
FL/FR
lactonic
gamma-
heptalactone
FL/FR
gamma-
octalactone
FL/FR
minty
myrtenal
FL/FR
musk
ethylene brassylate
FL/FR
nutty
coffee furanone
FL/FR
powdery
acetophenone
FL/FR
beta-
naphthyl ethyl ether
FL/FR
roasted
2-
acetyl pyrazine
FL/FR
sour
2-
methyl-2-pentenoic acid
FL/FR
spicy
benzyl cinnamate
FL/FR
cassia bark oil china
FL/FR
clove bud oil
FL/FR
black
currant bud absolute
FL/FR
eugenol
FL/FR
iso
eugenyl acetate
FL/FR
alpha-
methyl cinnamaldehyde
FL/FR
methyl cinnamate
FL/FR
methyl isoeugenol
FL/FR
3-
phenyl propyl alcohol
FL/FR
vanilla
ethyl vanillin
FL/FR
vanilla bean absolute (vanilla planifolia)
FL/FR
vanillyl acetate
FL/FR
vegetable
2-
octen-4-one
FL/FR
waxy
iso
amyl butyrate
FL/FR
decyl acetate
FL/FR
nonanol
FL/FR
woody
ambroxan
FL/FR
amyris wood oil
FL/FR
beta-
damascenone
FL/FR
delta-
damascone
FL/FR
frankincense oil
FL/FR
guaiacwood oil
FL/FR
alpha-
ionol
FL/FR
(E)-beta-
ionone
FL/FR
beta-
ionyl acetate
FL/FR
 
Potential Uses:
 acacia cassie farnesianaFR
 amberFR
 balsamFR
 bananaFR
 barleyFL
 beeswax cire d'abeilleFL/FR
 benzoin 
 berryFR
 berry jamFR
 breadFL
 butter rum 
 butterscotchFR
 cappuccinoFL
 caramelFL
 cherryFR
 cherry blackFR
 chocolate cacao 
 christmas blendsFR
 coconutFR
 cookie 
 cotton candyFR
 cream ice cream 
 cream sodaFL
 dateFR
 egg nogFL
 elder berryFR
 elder flowerFR
 fenugreekFL/FR
 fir balsamFR
 fruit punch 
 fruit tropical fruit 
 gingerbreadFR
 graham crackerFR
 grass sweetFR
 heliotropeFR
 honey mielFR
 honeysuckle chevrefeuilleFR
 immortelle helichrysum everlastingFL/FR
 incenseFR
 jackfruitFL
 jam 
 labdanumFL/FR
 licoriceFR
 lilac lilas syringaFR
 loganberry dewberryFR
 maltFR
 mapleFR
 marshmallowFL
 melon watermelon muskmelon cantaloupe 
 milk malted milk 
 mimosaFR
 molassesFL
 muguet lily of the valleyFR
 pineappleFR
 pralineFL
 pruneFR
 pumpkin pieFR
 raisinFR
 raspberryFR
 root beerFR
 sarsaparillaFL
 strawberryFR
 sugar brownFL
 sweet peaFR
 toasted 
 toffeeFR
 tonka beanFR
 tropicalFL
 valerianFL/FR
 vanillaFR
 wallflowerFR
 woodyFR
 
Occurrence (nature, food, other):note
 rue flower oil colombia @ 0.16%
Data GC Search Trop Picture
 
Synonyms:
4-benzo[1,3]dioxol-5-yl-butan-2-one
4-(2H-benzo[3,4-d]1,3-dioxolan-5-yl)butan-2-one
4-(benzo[d][1,3]dioxol-5-yl)butan-2-one
4-(1,3-benzodioxol-5-yl) butan-2-one
4-(1,3-benzodioxol-5-yl)-2-butanone
4-(1,3-benzodioxol-5-yl)butan-2-one
2-butanone, 4- (1,3-benzodioxol-5-yl)-
2-butanone, 4-(3,4-(methylenedioxy)phenyl)-
2-butanone, 4-[3,4-(methylenedioxy)phenyl]-
 dulcinyl (IFF)
 dulcinyl acetone
 dulcinyl recrystallized (IFF)
 dulcinyl recrystalsalicylatelized (IFF)
 heliotropin acetone
 heliotropinone
 heliotropyl acetone
4-(3,4-methylene dioxyphenyl)-2-butanone
3,4-(methylenedioxy)benzylacetone
4-(3,4-(methylenedioxy)phenyl)-2-butanone
4-[3,4-(methylenedioxy)phenyl]-2-butanone
3,4-methylenedioxybenzylacetone
4-(3,4-methylenedioxyphenyl)-2-butanone
 piperonal acetone
 piperonyl acetone
 piperonylacetone
 
 
Notes:
Used in food flavouring
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