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Details

Stereochemistry ACHIRAL
Molecular Formula C13H20O
Molecular Weight 192.2973
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-CYCLOHEXEN-1-ONE, 3-(2-BUTENYL)-2,4,4-TRIMETHYL-, (E)-

SMILES

C\C=C\CC1=C(C)C(=O)CCC1(C)C

InChI

InChIKey=CVDHBGKYPTUEAA-AATRIKPKSA-N
InChI=1S/C13H20O/c1-5-6-7-11-10(2)12(14)8-9-13(11,3)4/h5-6H,7-9H2,1-4H3/b6-5+

HIDE SMILES / InChI

Molecular Formula C13H20O
Molecular Weight 192.2973
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 20:39:48 GMT 2023
Edited
by admin
on Fri Dec 15 20:39:48 GMT 2023
Record UNII
I4CE2G8IBV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-CYCLOHEXEN-1-ONE, 3-(2-BUTENYL)-2,4,4-TRIMETHYL-, (E)-
Common Name English
MEGASTIGMA-5,8(E)-DIEN-4-ONE
Common Name English
(E)-3-(2-BUTENYL)-2,4,4-TRIMETHYLCYCLOHEX-2-EN-1-ONE
Systematic Name English
Code System Code Type Description
PUBCHEM
642507
Created by admin on Fri Dec 15 20:39:48 GMT 2023 , Edited by admin on Fri Dec 15 20:39:48 GMT 2023
PRIMARY
ECHA (EC/EINECS)
266-683-4
Created by admin on Fri Dec 15 20:39:48 GMT 2023 , Edited by admin on Fri Dec 15 20:39:48 GMT 2023
PRIMARY
CAS
67401-26-7
Created by admin on Fri Dec 15 20:39:48 GMT 2023 , Edited by admin on Fri Dec 15 20:39:48 GMT 2023
PRIMARY
FDA UNII
I4CE2G8IBV
Created by admin on Fri Dec 15 20:39:48 GMT 2023 , Edited by admin on Fri Dec 15 20:39:48 GMT 2023
PRIMARY