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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, TRANS-

SMILES

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

InChI

InChIKey=RVOKNSFEAOYULQ-YUMQZZPRSA-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-/m0/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 Sat Dec 16 11:01:02 GMT 2023
Edited
by admin
on Sat Dec 16 11:01:02 GMT 2023
Record UNII
K6Q2TQU7QS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-MENTHA-8-THIOL-3-ONE, TRANS-
Common Name English
8-MERCAPTO-P-MENTHAN-3-ONE, TRANS-
Common Name English
CYCLOHEXANONE, 2-(1-MERCAPTO-1-METHYLETHYL)-5-METHYL-, (2R,5R)-REL-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID201178446
Created by admin on Sat Dec 16 11:01:02 GMT 2023 , Edited by admin on Sat Dec 16 11:01:02 GMT 2023
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CAS
33281-91-3
Created by admin on Sat Dec 16 11:01:02 GMT 2023 , Edited by admin on Sat Dec 16 11:01:02 GMT 2023
PRIMARY
FDA UNII
K6Q2TQU7QS
Created by admin on Sat Dec 16 11:01:02 GMT 2023 , Edited by admin on Sat Dec 16 11:01:02 GMT 2023
PRIMARY
PUBCHEM
6951713
Created by admin on Sat Dec 16 11:01:02 GMT 2023 , Edited by admin on Sat Dec 16 11:01:02 GMT 2023
PRIMARY