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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H20O
Molecular Weight 192.2973
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(5-ISOPROPENYL-2-METHYL-1-CYCLOPENTEN-1-YL)-2-BUTANONE, (S)-

SMILES

CC(=O)CCC1=C(C)CC[C@H]1C(C)=C

InChI

InChIKey=DMGPXLFAXQJGKK-LBPRGKRZSA-N
InChI=1S/C13H20O/c1-9(2)12-7-5-10(3)13(12)8-6-11(4)14/h12H,1,5-8H2,2-4H3/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H20O
Molecular Weight 192.2973
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:24:34 GMT 2025
Edited
by admin
on Mon Mar 31 23:24:34 GMT 2025
Record UNII
NRG9W2V8FJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-BUTANONE, 4-(2-METHYL-5-(1-METHYLETHENYL)-1-CYCLOPENTEN-1-YL)-, (S)-
Preferred Name English
4-(5-ISOPROPENYL-2-METHYL-1-CYCLOPENTEN-1-YL)-2-BUTANONE, (S)-
Systematic Name English
4-((5S)-2-METHYL-5-PROP-1-EN-2-YLCYCLOPENTEN-1-YL)BUTAN-2-ONE
Systematic Name English
Code System Code Type Description
CAS
38231-13-9
Created by admin on Mon Mar 31 23:24:34 GMT 2025 , Edited by admin on Mon Mar 31 23:24:34 GMT 2025
PRIMARY
PUBCHEM
1761700
Created by admin on Mon Mar 31 23:24:34 GMT 2025 , Edited by admin on Mon Mar 31 23:24:34 GMT 2025
PRIMARY
FDA UNII
NRG9W2V8FJ
Created by admin on Mon Mar 31 23:24:34 GMT 2025 , Edited by admin on Mon Mar 31 23:24:34 GMT 2025
PRIMARY
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