hexyl butyrate (Q2928816)

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chemical compound

N-Hexyl N-butanoate
Hexyl butanoate
Butyric acid, hexyl ester
1-Hexyl butyrate
Butanoic acid, hexyl ester
N-Hexyl butyrate
N-Hexyl N-butyrate
N-Hexyl butanoate
hexyl butanoate

Language	Label	Description	Also known as
English	hexyl butyrate	chemical compound	N-Hexyl N-butanoate Hexyl butanoate Butyric acid, hexyl ester 1-Hexyl butyrate Butanoic acid, hexyl ester N-Hexyl butyrate N-Hexyl N-butyrate N-Hexyl butanoate hexyl butanoate

Statements

type of chemical entity

0 references

biogenic acyclic ester

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chemical structure

Hexyl butyrate.PNG
982 × 241; 7 KB

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172.146±0 dalton

1 reference

language of work or name

2639-63-6 (English)

9 October 2016

chemical formula

C₁₀H₂₀O₂

1 reference

language of work or name

2639-63-6 (English)

9 October 2016

canonical SMILES

CCCCCCOC(=O)CCC

1 reference

language of work or name

2639-63-6 (English)

9 October 2016

1 reference

Composition of oxygenated compounds in peel oil from Citrus iyo and its variation during storage.

Thymus willkommii

1 reference

Composition and variability of the essential oil of Thymus willkomii

Lavandula latifolia

2 references

The Essential Oil ofLavandulaxhybridaBalb. ex Ging., a Distinct Hybrid fromL.xheterophyllaPoir. (Labiatae)

The Essential Oil ofLavandulaxhybridaBalb. ex Ging., a Distinct Hybrid fromL.xheterophyllaPoir. (Labiatae)

Mandragora autumnalis

1 reference

Substances isolated from Mandragora species

Mandragora officinarum

1 reference

Substances isolated from Mandragora species

Cleistopholis patens

1 reference

Volatile Components of Cleistopholis patens

Heracleum antasiaticum

1 reference

Essential oil ofHeracleum antasiaticum

Heracleum persicum

1 reference

Composition of Essential Oil of Heracleum persicum Fruits

Lavandula angustifolia

1 reference

Composition of the Essential Oil of Lavender (Lavandula angustifoliaMill.) from Lithuania

Malpighia punicifolia

1 reference

Chemical composition of acerola fruit (Malpighia punicifolia L.) at three stages of maturity

Pelargonium quercifolium

1 reference

Analysis of Essential Oils from Selected Cultivars of Pelargonium quercifolium by GC/MS

Prunus armeniaca

1 reference

Volatile constituents of apricot (Prunus armeniaca)

Spondias mombin

2 references

Free and glycosidically bound aroma compounds in hog plum (Spondias mombins L.)

Volatiles of the Jobo Fruit (Spondias mombinL.)

Vanilla planifolia

1 reference

Identification of some Ester Compounds in Bourbon Vanilla Beans

Pternistria bispina

1 reference

Volatile constituents of the scent gland reservoir of the coreoid, Pternistria bispina Stal

Thymus camphoratus

1 reference

Composition and infraspecific variability of essential oil from Thymus camphoratus

Acca sellowiana

1 reference

Compositional Analysis and Aroma Evaluation of Feijoa Essential Oils from New Zealand Grown Cultivars

Cannabis sativa

1 reference

Constituents of Cannabis sativa L. XVII. A review of the natural constituents

Mangifera indica

1 reference

Volatile components from mango (Mangifera indica L.) cultivars

1 reference

Volatile organic compounds in the aril juices and seeds from selected five pomegranate (Punica granatum L.) cultivars

Capsicum annuum

1 reference

Influence of different drying technologies on the volatile components of chilli (<I>Capsicum annuum</I> L.) powder

Osmanthus fragrans

1 reference

Headspace Analysis of Osmanthus fragrans Lour.

Malpighia glabra

1 reference

Chemical composition of acerola fruit (Malpighia punicifolia L.) at three stages of maturity

Malpighia emarginata

1 reference

Chemical composition of acerola fruit (Malpighia punicifolia L.) at three stages of maturity

Heracleum stevenii

1 reference

Composition of the Essential Oils of Heracleum stevenii Manden.

Passiflora edulis

1 reference

The chemistry of food flavour. I. Volatile constituents of passionfruit, Passiflora edulis

Identifiers

InChI=1S/C10H20O2/c1-3-5-6-7-9-12-10(11)8-4-2/h3-9H2,1-2H3

1 reference

language of work or name

2639-63-6 (English)

9 October 2016

XAPCMTMQBXLDBB-UHFFFAOYSA-N

2 references

language of work or name

2639-63-6 (English)

9 October 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

language of work or name

hexyl butyrate (English)

9 October 2016

CAS Common Chemistry

6 April 2021

https://commonchemistry.cas.org/detail?cas_rn=2639-63-6

XAPCMTMQBXLDBB-UHFFFAOYSA-N

1 reference

language of work or name

Hexyl butyrate (English)

9 October 2016

2 references

language of work or name

2639-63-6 (English)

9 October 2016

matched by identifier from

XAPCMTMQBXLDBB-UHFFFAOYSA-N

Reaxys registry number

1754469

1 reference

language of work or name

hexyl butyrate (English)

9 October 2016

mapping relation type

2 references

language of work or name

hexyl butyrate (English)

9 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C10H20O2/c1-3-5-6-7-9-12-10(11)8-4-2/h3-9H2,1-2H3

1 reference

language of work or name

CHEMBL3182794 (English)

9 October 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

XAPCMTMQBXLDBB-UHFFFAOYSA-N

UniChem compound ID

1 reference

MassBank accession ID

MSBNK-Fac_Eng_Univ_Tokyo-JP006503

0 references

splash10-0006-9500000000-c8872258839b61d390df

0 references

ET4203000

1 reference

imported from Wikimedia project

French Wikipedia

DSSTox substance ID

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

matched by identifier from

XAPCMTMQBXLDBB-UHFFFAOYSA-N

DSSTOX compound identifier

0 references

1 reference

Global Substance Registration System

language of work or name

HEXYL BUTYRATE (English)

9 October 2016

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

Hexyl butyrate (English)

CAS no.: 2639-63-6 (English)

09.045

1 reference

CAS no.: 2639-63-6 (English)

23 January 2021

09.045

1 reference

CosIng database

28 December 2019

HEXYL BUTYRATE (English)

CAS no.: 2639-63-6 (English)

Cannabis Database ID

1 reference

Cannabis Database

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

XAPCMTMQBXLDBB-UHFFFAOYSA-N

3 references

language of work or name

hexyl butyrate (English)

9 October 2016

based on heuristic

inferred from InChIKey

matched by identifier from

XAPCMTMQBXLDBB-UHFFFAOYSA-N

2 references

Global Substance Registration System

language of work or name

HEXYL BUTYRATE (English)

9 October 2016

matched by identifier from

XAPCMTMQBXLDBB-UHFFFAOYSA-N

0 references

Google Knowledge Graph ID

0 references

JECFA database ID

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153

1 reference

Evaluations of the Joint FAO/WHO Expert Committee on Food Additives (JECFA)

13 May 2021

Sitelinks

Wikipedia(5 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

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