(Q27291980)

Hexyl benzoate (English)

14 October 2016

chemical formula

C₁₃H₁₈O₂

1 reference

Hexyl benzoate (English)

14 October 2016

canonical SMILES

CCCCCCOC(=O)C1=CC=CC=C1

1 reference

Study on the composition of the volatile fraction of Hamamelis virginiana

Hexyl benzoate (English)

14 October 2016

1 reference

Tilia mandshurica

1 reference

The Composition of Essential Oils fromTiliaL. Species Growing in Turkey

Tilia tomentosa

1 reference

The Composition of Essential Oils fromTiliaL. Species Growing in Turkey

Vaccinium vitis-idaea

2 references

The Aroma of Cranberries. II. Vaccinium macrocarpon Ait.

The Aroma of Cranberries. I. Vaccinium vitis-idaea L..

Acca sellowiana

1 reference

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

Dianthus caryophyllus

2 references

Cyclic malyl anthocyanins in Dianthus caryophyllus

Effect of Some Bioregulators on the Chemical Composition of Essential Oil and its Antioxidant Activity of Egyptian Carnation (Dianthus caryophyllus L.)

0 references

0 references

0 references

Identifiers

InChI

InChI=1S/C13H18O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3

1 reference

Hexyl benzoate (English)

14 October 2016

1 reference

Global Substance Registration System

Hexyl benzoate (English)

14 October 2016

2 references

hexyl benzoate (English)

14 October 2016

https://commonchemistry.cas.org/detail?cas_rn=6789-88-4

8 April 2021

1 reference

Hexyl benzoate (English)

14 October 2016

2 references

Hexyl benzoate (English)

14 October 2016

ChEBI ID

165206

mapping relation type

exact match

2 references

ChEBI release 2021-03-01

International Chemical Identifier

InChI

InChI=1S/C13H18O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3

1 reference

BENZOIC ACID HEXYL ESTER (English)

14 October 2016

2 references

inferred from InChIKey

MSBNK-Fac_Eng_Univ_Tokyo-JP001510

1 reference

MassBank accession ID

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP001844

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP003141

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP005902

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP005965

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP009731

0 references

MSBNK-Fac_Eng_Univ_Tokyo-JP008492

0 references

SPLASH

splash10-0ab9-8900000000-f68dec8f8af75af595c8

0 references

splash10-0ab9-9800000000-75cd7a93b063fca7a7df

0 references

splash10-05fr-4900000000-6277c2ee9ea970dca1b3

0 references

splash10-05fr-2900000000-a8607e4d6d2c756ca304

0 references

splash10-0ab9-9800000000-dfb349b635d78bc84bca

0 references

splash10-05fr-3900000000-c9118a2ac789e99690dd

0 references

0 references

1 reference

Hazardous Substances Data Bank

28 October 2019

N-HEXYL BENZOATE (English)

10 May 2021

2 references

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

DSSTOX compound identifier

DTXCID505403

0 references

EC number

229-856-5

1 reference

Global Substance Registration System

hexyl benzoate (English)

ECHA Substance Infocard ID

14 October 2016

100.027.142

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.027.142

27 December 2018

AICS Chemical ID (BEING DELETED)

Hexyl benzoate (English)

quotation

CAS no.: 6789-88-4 (English)

FL number

09.768

1 reference

quotation

CAS no.: 6789-88-4 (English)

23 January 2021

09.768

1 reference

28 December 2019

HEXYL BENZOATE (English)

quotation

CAS no.: 6789-88-4 (English)

10769

0 references

Human Metabolome Database ID

HMDB0040431

2 references

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00055911

2 references

based on heuristic

inferred from InChIKey

2 references

Global Substance Registration System

hexyl benzoate (English)

14 October 2016

JECFA number

854

1 reference

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