(Q27286127)

cis-3-Hexenyl benzoate (English)

14 October 2016

chemical formula

C₁₃H₁₆O₂

1 reference

cis-3-Hexenyl benzoate (English)

14 October 2016

canonical SMILES

CCC=CCCOC(=O)C1=CC=CC=C1

1 reference

cis-3-Hexenyl benzoate (English)

14 October 2016

isomeric SMILES

CC/C=C\CCOC(=O)C1=CC=CC=C1

1 reference

The essential oil constituents and antimicrobial activity of Anthemis aciphylla BOISS. var. discoidea BOISS.

cis-3-Hexenyl benzoate (English)

14 October 2016

1 reference

Hypericum perforatum

1 reference

Variation in the composition of the essential oils, phenolic compounds and mineral elements of Hypericum perforatum L. growing in Estonia

Quercus agrifolia

1 reference

Volatile components of california live oak, quercus agrifolia

Vaccinium vitis-idaea

1 reference

The Aroma of Cranberries. II. Vaccinium macrocarpon Ait.

Acca sellowiana

1 reference

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

Psidium guajava

1 reference

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

Identifiers

InChI

InChI=1S/C13H16O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h3-7,9-10H,2,8,11H2,1H3/b4-3-

1 reference

cis-3-Hexenyl benzoate (English)

BCOXBEHFBZOJJZ-ARJAWSKDSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

cis-3-Hexenyl benzoate (English)

14 October 2016

2 references

(3Z)-3-hexenyl benzoate (English)

BCOXBEHFBZOJJZ-ARJAWSKDSA-N

14 October 2016

InChIKey

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=25152-85-6

1 reference

(3Z)-3-Hexen-1-yl benzoate (English)

14 October 2016

1 reference

cis-3-Hexenyl benzoate (English)

14 October 2016

ChEBI ID

156235

mapping relation type

exact match

1 reference

ChEBI release 2021-03-01

1 reference

MSBNK-Fac_Eng_Univ_Tokyo-JP008491

CHEMBL3182851 (English)

14 October 2016

1 reference

MassBank accession ID

0 references

SPLASH

splash10-0arr-9200000000-81473c0496fc70351f74

0 references

DSSTox substance ID

DTXSID3047554

1 reference

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

DSSTOX compound identifier

DTXCID1027554

0 references

EC number

246-669-4

1 reference

Global Substance Registration System

(3Z)-3-hexenyl benzoate (English)

ECHA Substance Infocard ID

14 October 2016

100.042.412

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.042.412

27 December 2018

AICS Chemical ID (BEING DELETED)

(Z)-hex-3-enyl benzoate (English)

quotation

CAS no.: 25152-85-6 (English)

FL number

09.806

1 reference

quotation

CAS no.: 25152-85-6 (English)

23 January 2021

09.806

1 reference

28 December 2019

CIS-3-HEXENYL BENZOATE (English)

quotation

CAS no.: 25152-85-6 (English)

16099

0 references

Human Metabolome Database ID

HMDB0033379

1 reference

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00029345

1 reference

based on heuristic

inferred from InChIKey

1 reference

Global Substance Registration System

(3Z)-3-hexenyl benzoate (English)

14 October 2016

JECFA number

858

1 reference

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