hexyl acetate (Q418672)

Hexyl acetate (English)

9 October 2016

chemical formula

C₈H₁₆O₂

1 reference

Hexyl acetate (English)

9 October 2016

canonical SMILES

CCCCCCOC(=O)C

1 reference

Hexyl acetate (English)

9 October 2016

melting point

−80 degree Celsius

1 reference

Jean-Claude Bradley Open Melting Point Dataset

found in taxon

Citrus ×iyo

1 reference

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

Avena sativa

1 reference

Oat leaf volatiles: possible insect attractants

Vitis rotundifolia

1 reference

Volatile constituents of the muscadine grape (Vitis rotundifolia)

Quercus agrifolia

1 reference

Volatile components of california live oak, quercus agrifolia

Psidium guajava

3 references

Volatile flavour components of guava

Volatile compounds in different parts of the fruit Psidium guajava L. cv. "Media China" identified at distinct phenological stages using HS-SPME-GC-QTOF/MS

Chemical Composition of the Essential Oil and Headspace Solid-Phase Microextraction of the Guava Fruit (Psidium guajava L.)

Salvia reuteriana

1 reference

Essential oil composition of twoSalvia species from Iran,Salvia nemorosa L. andSalvia reuterana Boiss.

Mandragora autumnalis

1 reference

Substances isolated from Mandragora species

Mandragora officinarum

1 reference

Substances isolated from Mandragora species

rooibos

1 reference

Volatile components of Rooibos tea (Aspalathus linearis)

Boswellia sacra

1 reference

The essential oil of olibanum

Cucumis melo

1 reference

Identification of Additional Volatile Compounds from Cbntaloupe

Festuca arundinacea

1 reference

Composition of essential oil of tall fescue

mangosteen

1 reference

Volatile flavour components of mangosteen, Garcinia mangostana

Helichrysum ambiguum

1 reference

Composition and antibacterial activity of the essential oils of Helichrysum rupestre and H. ambiguum growing in the Balearic Islands (Part III)

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

Olea europaea

1 reference

Analysis of volatiles from callus cultures of olive Olea europaea

Osmorhiza aristata

1 reference

Studies on the Constituents of Osmorhiza aristata (THUNB.) MAKINO et YABE

Chinese peony

1 reference

Volatile constituents of peony flowers

Picea abies

1 reference

Odoriferous compounds from the flowers of the conifers Picea abies, pinus sylvestris and Larix sibirica

Polygala senega

1 reference

Volatile compounds ofPolygala senega L. var.latifolia Torrey et Gray roots

Pyrus pyrifolia

1 reference

Volatiles of Ripe Asian Pears (Pyrus serotinaRehder)

Spondias mombin

1 reference

Volatiles of the Jobo Fruit (Spondias mombinL.)

Lonicera japonica

1 reference

Genetic variation and metabolic pathway intricacy govern the active compound content and quality of the Chinese medicinal plant Lonicera japonica thunb

Pternistria bispina

1 reference

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

Acca sellowiana

1 reference

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

Boswellia carteri

1 reference

The essential oil of olibanum

Cannabis sativa

1 reference

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

Escherichia coli

1 reference

Expanding ester biosynthesis in Escherichia coli

soybean

1 reference

Volatiles from the foliage of soybean, Glycine max, and lima bean, Phaseolus lunatus: their behavioral effects on the insects Trichoplusia ni and Epilachna varivestis

Polla

1 reference

Chemical composition of commercial cold-pressed pomegranate (Punica granatum) seed oil from Turkey and Israel, and the use of bioactive compounds for samples’ origin preliminary discrimination

tomato

2 references

Relationships between the volatile compounds evaluated by solid phase microextraction and the thermal treatment of tomato juice: optimization of the blanching parameters

Effect of autochthonous lactic acid bacteria starters on health-promoting and sensory properties of tomato juices

Mimusops elengi

1 reference

Volatile Components of Mimusops elengi L. Flowers

Malus pumila

1 reference

Headspace and essential oil analysis of apple flowers

Chrysocephalum ambiguum

1 reference

Composition and antibacterial activity of the essential oils of Helichrysum rupestre and H. ambiguum growing in the Balearic Islands (Part III)

Festuca rubra

1 reference

Composition of essential oil of tall fescue

Passiflora edulis

1 reference

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

Malus domestica

1 reference

Headspace and essential oil analysis of apple flowers

Matsutake

1 reference

Volatile flavor compounds of Matsutake-Tricholomam atsutake (Ito et Imai) Sing.

1 reference

Hexyl acetate

0 references

Identifiers

InChI

InChI=1S/C8H16O2/c1-3-4-5-6-7-10-8(2)9/h3-7H2,1-2H3

1 reference

Hexyl acetate (English)

9 October 2016

2 references

Hexyl acetate (English)

9 October 2016

14 February 2018

3 references

hexyl acetate (English)

9 October 2016

14 February 2018

https://commonchemistry.cas.org/detail?cas_rn=142-92-7

8 April 2021

1 reference

Hexyl acetate (English)

9 October 2016

2 references

Hexyl acetate (English)

9 October 2016

Reaxys registry number

1747138

1 reference

hexyl acetate (English)

9 October 2016

ChEBI ID

87510

mapping relation type

3 references

hexyl acetate (English)

9 October 2016

ChEBI release 2021-03-01

International Chemical Identifier

InChI

InChI=1S/C8H16O2/c1-3-4-5-6-7-10-8(2)9/h3-7H2,1-2H3

1 reference

HEXYL ACETATE (English)

9 October 2016

2 references

inferred from InChIKey

MSBNK-Fac_Eng_Univ_Tokyo-JP001308

1 reference

MassBank accession ID

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP001528

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP005929

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP006811

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP005163

0 references

SPLASH

splash10-052f-9500000000-8bde2be982cc06c303c6

0 references

splash10-0a5c-9500000000-6b68e54666d458c23e6b

0 references

splash10-0ab9-9500000000-d6e7e57e88fb673af069

0 references

splash10-0006-9500000000-88601f99d038175f4279

0 references

splash10-052f-9500000000-f72b4cda7606150aa804

0 references

0 references

0 references

1 reference

Hazardous Substances Data Bank

28 October 2019

n-Hexyl Acetate (English)

10 May 2021

2 references

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

DSSTOX compound identifier

0 references

0 references

1 reference

ECHA Substance Infocard ID

14 February 2018

100.005.066

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.005.066

27 December 2018

Hexyl acetate (English)

quotation

CAS no.: 142-92-7 (English)

FL number

09.006

1 reference

quotation

CAS no.: 142-92-7 (English)

23 January 2021

09.006

1 reference

28 December 2019

HEXYL ACETATE (English)

quotation

CAS no.: 142-92-7 (English)

1 reference

1 reference

Human Metabolome Database ID

14 February 2018

HMDB0029980

2 references

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00035701

2 references

based on heuristic

inferred from InChIKey

2 references

14 February 2018

0 references

1 reference

6 April 2020

1 reference

28 October 2013

0 references

128

1 reference

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