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Details

Stereochemistry RACEMIC
Molecular Formula C15H24O2
Molecular Weight 236.3499
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-IONYL ACETATE, (E)-

SMILES

CC(OC(C)=O)\C=C\C1=C(C)CCCC1(C)C

InChI

InChIKey=WODKSVNXBYBTQC-CMDGGOBGSA-N
InChI=1S/C15H24O2/c1-11-7-6-10-15(4,5)14(11)9-8-12(2)17-13(3)16/h8-9,12H,6-7,10H2,1-5H3/b9-8+

HIDE SMILES / InChI

Approval Year

Name Type Language
.BETA.-IONYL ACETATE, (E)-
Common Name English
.BETA.-LONYL ACETATE [FHFI]
Common Name English
.BETA.-LONYL ACETATE, (E)-
Common Name English
(±)-.BETA.-LONYL ACETATE, (E)-
Common Name English
3-BUTEN-2-OL, 4-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)-, ACETATE, (E)-
Systematic Name English
IONYL ACETATE, .BETA.-
Common Name English
3-BUTEN-2-OL, 4-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)-, 2-ACETATE, (3E)-
Common Name English
.BETA.-LONYL ACETATE, (E)-(±)-
Common Name English
FEMA NO. 3844
Code English
Classification Tree Code System Code
JECFA EVALUATION BETA-IONYL ACETATE
Created by admin on Sat Dec 16 01:02:49 GMT 2023 , Edited by admin on Sat Dec 16 01:02:49 GMT 2023
Code System Code Type Description
CAS
53319-91-8
Created by admin on Sat Dec 16 01:02:49 GMT 2023 , Edited by admin on Sat Dec 16 01:02:49 GMT 2023
PRIMARY
FDA UNII
7416U6WD2T
Created by admin on Sat Dec 16 01:02:49 GMT 2023 , Edited by admin on Sat Dec 16 01:02:49 GMT 2023
PRIMARY
JECFA MONOGRAPH
1198
Created by admin on Sat Dec 16 01:02:49 GMT 2023 , Edited by admin on Sat Dec 16 01:02:49 GMT 2023
PRIMARY
PUBCHEM
5797328
Created by admin on Sat Dec 16 01:02:49 GMT 2023 , Edited by admin on Sat Dec 16 01:02:49 GMT 2023
PRIMARY