(Q27160291)

3-METHYL-2-CYCLOHEXEN-1-ONE (English)

9 October 2016

chemical formula

C₇H₁₀O

1 reference

3-METHYL-2-CYCLOHEXEN-1-ONE (English)

18 November 2016

canonical SMILES

CC1=CC(=O)CCC1

1 reference

Terpenoid composition of Lippia dulcis

3-METHYL-2-CYCLOHEXEN-1-ONE (English)

18 November 2016

1 reference

Mentha pulegium

1 reference

Etudes sur les matières végétales volatiles XXI. Sur la composition et l'analyse de l'essence de menthe pouliot. (Mentha pulegiumL.)

Nicotiana tabacum

2 references

A Chemical Study of Burley Tobacco Flavour (Nicotiana tabacum L.). I. Volatile to medium-volatile constituents (b.p. ≦ 84°/0.001 Torr

Comparison of different extraction methods: steam distillation, simultaneous distillation and extraction and headspace co-distillation, used for the analysis of the volatile components in aged flue-cured tobacco leaves

Identifiers

InChI

InChI=1S/C7H10O/c1-6-3-2-4-7(8)5-6/h5H,2-4H2,1H3

1 reference

3-METHYL-2-CYCLOHEXEN-1-ONE (English)

18 November 2016

2 references

3-METHYL-2-CYCLOHEXEN-1-ONE (English)

18 November 2016

ChEBI release 2020-09-01

CAS Registry Number

1193-18-6

2 references

Global Substance Registration System

3-methyl-2-cyclohexen-1-one (English)

18 November 2016

https://commonchemistry.cas.org/detail?cas_rn=1193-18-6

10 April 2021

1 reference

L6V BUTJ C1 (English)

18 November 2016

2 references

3-METHYL-2-CYCLOHEXEN-1-ONE (English)

18 November 2016

ChEBI ID

88428

mapping relation type

2 references

CHEMBL3139347 (English)

18 November 2016

International Chemical Identifier

InChI

InChI=1S/C7H10O/c1-6-3-2-4-7(8)5-6/h5H,2-4H2,1H3

1 reference

CHEMBL3139347 (English)

18 November 2016

2 references

inferred from InChIKey

MSBNK-Fac_Eng_Univ_Tokyo-JP008565

1 reference

MassBank accession ID

0 references

SPLASH

splash10-001i-9100000000-1f14f50705992aa13677

0 references

NMRShiftDB structure ID

10015790

1 reference

DSSTox substance ID

DTXSID8035186

2 references

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

DSSTOX compound identifier

0 references

0 references

214-769-7

1 reference

Global Substance Registration System

3-methyl-2-cyclohexen-1-one (English)

ECHA Substance Infocard ID

18 November 2016

100.013.427

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.013.427

27 December 2018

PesticideInfo chemical ID

3-methylcyclohex-2-en-1-one (English)

quotation

CAS no.: 1193-18-6 (English)

PRI552

0 references

AICS Chemical ID (BEING DELETED)

6202

0 references

Human Metabolome Database ID

HMDB0031541

2 references

based on heuristic

inferred from InChIKey

KNApSAcK ID

C00059387

2 references

based on heuristic

inferred from InChIKey

2 references

Global Substance Registration System

3-methyl-2-cyclohexen-1-one (English)

18 November 2016