DIHYDRO-.BETA.-IONONE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H22O
Molecular Weight	194.3132
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DIHYDRO-.BETA.-IONONE

Structure Search

SMILES

CC(=O)CCC1=C(C)CCCC1(C)C

InChI

InChIKey=QJJDNZGPQDGNDX-UHFFFAOYSA-N

InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-9H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C13H22O
Molecular Weight	194.3132
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:41:23 GMT 2023` Edited by `admin` on `Fri Dec 15 18:41:23 GMT 2023`
Record UNII	710YK6CESE
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

DIHYDRO-.BETA.-IONONE

Common Name

English

DIHYDRO-.BETA.-IONONE [FHFI]

Common Name

English

FEMA NO. 3626

Code

English

DIHYDRO-BETA-IONONE

Common Name

English

4-(2,6,6-TRIMETHYL-1-CYCLOHEXENYL)BUTAN-2-ONE

Systematic Name

English

2-BUTANONE, 4-(2,6,6- TRIMETHYL-1-CYCLOHEXEN-1-YL)-

Common Name

English

Classification Tree Code System Code

JECFA EVALUATION

DIHYDRO-BETA-IONONE

Created by admin on Fri Dec 15 18:41:23 GMT 2023 , Edited by admin on Fri Dec 15 18:41:23 GMT 2023

Code System Code Type Description

PUBCHEM

519382

Created by admin on Fri Dec 15 18:41:23 GMT 2023 , Edited by admin on Fri Dec 15 18:41:23 GMT 2023

PRIMARY

CHEBI

18015

Created by admin on Fri Dec 15 18:41:23 GMT 2023 , Edited by admin on Fri Dec 15 18:41:23 GMT 2023

PRIMARY

EPA CompTox

DTXSID4047200

Created by admin on Fri Dec 15 18:41:23 GMT 2023 , Edited by admin on Fri Dec 15 18:41:23 GMT 2023

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FDA UNII

710YK6CESE

Created by admin on Fri Dec 15 18:41:23 GMT 2023 , Edited by admin on Fri Dec 15 18:41:23 GMT 2023

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JECFA MONOGRAPH

86

Created by admin on Fri Dec 15 18:41:23 GMT 2023 , Edited by admin on Fri Dec 15 18:41:23 GMT 2023

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ECHA (EC/EINECS)

241-318-1

Created by admin on Fri Dec 15 18:41:23 GMT 2023 , Edited by admin on Fri Dec 15 18:41:23 GMT 2023

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CAS

17283-81-7

Created by admin on Fri Dec 15 18:41:23 GMT 2023 , Edited by admin on Fri Dec 15 18:41:23 GMT 2023

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