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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H22O
Molecular Weight 218.3346
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (6S)-2-Methyl-6-(4-methyl-1,3-cyclohexadien-1-yl)-2-hepten-4-one

SMILES

C[C@@H](CC(=O)C=C(C)C)C1=CC=C(C)CC1

InChI

InChIKey=ZMIQNSSHYBJKIL-ZDUSSCGKSA-N
InChI=1S/C15H22O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5,7,9,13H,6,8,10H2,1-4H3/t13-/m0/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
(6S)-2-Methyl-6-(4-methyl-1,3-cyclohexadien-1-yl)-2-hepten-4-one
Systematic Name English
2-Hepten-4-one, 2-methyl-6-(4-methyl-1,3-cyclohexadien-1-yl)-, (6S)-
Systematic Name English
Code System Code Type Description
CAS
1866357-36-9
Created by admin on Sat Dec 16 19:27:28 GMT 2023 , Edited by admin on Sat Dec 16 19:27:28 GMT 2023
PRIMARY
FDA UNII
939YF99ARH
Created by admin on Sat Dec 16 19:27:28 GMT 2023 , Edited by admin on Sat Dec 16 19:27:28 GMT 2023
PRIMARY
PUBCHEM
127047698
Created by admin on Sat Dec 16 19:27:28 GMT 2023 , Edited by admin on Sat Dec 16 19:27:28 GMT 2023
PRIMARY
NIH
NCATS
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