U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C13H18O
Molecular Weight 190.2814
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-DAMASCENONE

SMILES

C\C=C\C(=O)C1=C(C)C=CCC1(C)C

InChI

InChIKey=POIARNZEYGURDG-FNORWQNLSA-N
InChI=1S/C13H18O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5-8H,9H2,1-4H3/b7-5+

HIDE SMILES / InChI

Approval Year

Name Type Language
.BETA.-DAMASCENONE
MI  
Common Name English
(E)-1-(2,6,6-TRIMETHYL-1,3-CYCLOHEXADIEN-1-YL)-2-BUTEN-1-ONE
Systematic Name English
4-(2,6,6-TRIMETHYL CYCLOHEXA-1,3-DIENYL) BUT-2-EN-4-ONE [FHFI]
Common Name English
FEMA NO. 3420
Code English
(E)-1-(2,6,6-TRIMETHYL-1-CYCLOHEXA-1,3-DIENYL)BUT-2-EN-1-ONE
Systematic Name English
TRANS-.BETA.-DAMASCENON
Common Name English
DAMASCENONE,.BETA.-
Common Name English
.BETA.-DAMASCENONE [MI]
Common Name English
.BETA.-DAMASCENON, TRANS-
Common Name English
(E)-.BETA.-DAMASCENONE
Common Name English
4-(2,6,6-TRIMETHYLCYCLOHEXA-1,3-DIENYL)BUT-2-EN-4-ONE
Systematic Name English
BETA-DAMASCENONE
Common Name English
DAMASCENONE
Common Name English
TRANS-DAMASCENONE
Common Name English
Code System Code Type Description
EVMPD
SUB115709
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
PRIMARY
MERCK INDEX
m4078
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
PRIMARY Merck Index
WIKIPEDIA
DAMASCENONE
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
PRIMARY
PUBCHEM
5366074
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
PRIMARY
CAS
23696-85-7
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
CAS
23726-93-4
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
PRIMARY
CHEBI
67251
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
PRIMARY
JECFA MONOGRAPH
341
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
PRIMARY
FDA UNII
U66V25TBO0
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
PRIMARY
SMS_ID
100000142136
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
PRIMARY
ECHA (EC/EINECS)
245-844-2
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
PRIMARY
MESH
C075388
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
PRIMARY
ECHA (EC/EINECS)
245-833-2
Created by admin on Fri Dec 15 18:03:44 GMT 2023 , Edited by admin on Fri Dec 15 18:03:44 GMT 2023
ALTERNATIVE