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

Details

Stereochemistry RACEMIC
Molecular Formula C10H18OS
Molecular Weight 186.314
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of P-MENTHA-8-THIOL-3-ONE, CIS-

SMILES

C[C@@H]1CC[C@@H](C(=O)C1)C(C)(C)S

InChI

InChIKey=RVOKNSFEAOYULQ-SFYZADRCSA-N
InChI=1S/C10H18OS/c1-7-4-5-8(9(11)6-7)10(2,3)12/h7-8,12H,4-6H2,1-3H3/t7-,8+/m1/s1

HIDE SMILES / InChI

Molecular Formula C10H18OS
Molecular Weight 186.314
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 11:18:56 GMT 2025
Edited
by admin
on Wed Apr 02 11:18:56 GMT 2025
Record UNII
PP49989A6X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-MERCAPTO-P-MENTHAN-3-ONE, CIS-
Preferred Name English
P-MENTHA-8-THIOL-3-ONE, CIS-
Common Name English
CIS-2-(1-MERCAPTO-1-METHYLETHYL)-5-METHYLCYCLOHEXAN-1-ONE
Systematic Name English
CYCLOHEXANONE, 2-(1-MERCAPTO-1-METHYLETHYL)-5-METHYL-, (2R,5S)-REL-
Systematic Name English
P-MENTHAN-3-ONE, 8-MERCAPTO-, CIS-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID701176752
Created by admin on Wed Apr 02 11:18:56 GMT 2025 , Edited by admin on Wed Apr 02 11:18:56 GMT 2025
PRIMARY
PUBCHEM
6951714
Created by admin on Wed Apr 02 11:18:56 GMT 2025 , Edited by admin on Wed Apr 02 11:18:56 GMT 2025
PRIMARY
CAS
33284-96-7
Created by admin on Wed Apr 02 11:18:56 GMT 2025 , Edited by admin on Wed Apr 02 11:18:56 GMT 2025
PRIMARY
FDA UNII
PP49989A6X
Created by admin on Wed Apr 02 11:18:56 GMT 2025 , Edited by admin on Wed Apr 02 11:18:56 GMT 2025
PRIMARY