U.S. Department of Health & Human Services Divider Arrow 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

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

Approval Year

Name Type Language
DIHYDRO-.BETA.-IONONE
FHFI  
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
PRIMARY
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
PRIMARY
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
PRIMARY
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
PRIMARY
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
PRIMARY