DIHYDROMETHYL-.ALPHA.-IONONE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C14H24O
Molecular Weight	208.3398
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DIHYDROMETHYL-.ALPHA.-IONONE

Structure Search

SMILES

CCC(=O)CCC1C(C)=CCCC1(C)C

InChI

InChIKey=KUZMAEUMYSXKOU-UHFFFAOYSA-N

InChI=1S/C14H24O/c1-5-12(15)8-9-13-11(2)7-6-10-14(13,3)4/h7,13H,5-6,8-10H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C14H24O
Molecular Weight	208.3398
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:38:05 GMT 2025` Edited by `admin` on `Mon Mar 31 22:38:05 GMT 2025`
Record UNII	4PH8D3YJET
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIHYDROMETHYL-.ALPHA.-IONONE

Common Name

English

DIHYDROMETHYL-ALPHA-IONONE

Preferred Name

English

1-(2,6,6-TRIMETHYL-2-CYCLOHEXEN-1-YL)-3-PENTANONE

Systematic Name

English

3-PENTANONE, 1-(2,6,6-TRIMETHYL-2-CYCLOHEXEN-1-YL)-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID80867698

Created by admin on Mon Mar 31 22:38:05 GMT 2025 , Edited by admin on Mon Mar 31 22:38:05 GMT 2025

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CAS

68480-17-1

Created by admin on Mon Mar 31 22:38:05 GMT 2025 , Edited by admin on Mon Mar 31 22:38:05 GMT 2025

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ECHA (EC/EINECS)

270-894-7

Created by admin on Mon Mar 31 22:38:05 GMT 2025 , Edited by admin on Mon Mar 31 22:38:05 GMT 2025

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FDA UNII

4PH8D3YJET

Created by admin on Mon Mar 31 22:38:05 GMT 2025 , Edited by admin on Mon Mar 31 22:38:05 GMT 2025

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PUBCHEM

109420

Created by admin on Mon Mar 31 22:38:05 GMT 2025 , Edited by admin on Mon Mar 31 22:38:05 GMT 2025

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