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Details

Stereochemistry RACEMIC
Molecular Formula C12H20O2S
Molecular Weight 228.351
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MENTHONE-8-THIOACETATE, CIS-

SMILES

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

InChI

InChIKey=AMXPURQVAMENCC-WCBMZHEXSA-N
InChI=1S/C12H20O2S/c1-8-5-6-10(11(14)7-8)12(3,4)15-9(2)13/h8,10H,5-7H2,1-4H3/t8-,10+/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H20O2S
Molecular Weight 228.351
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 00:20:57 UTC 2023
Edited
by admin
on Sat Dec 16 00:20:57 UTC 2023
Record UNII
C5YD55048E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MENTHONE-8-THIOACETATE, CIS-
Common Name English
ETHANETHIOIC ACID, S-(1-METHYL-1-(4-METHYL-2-OXOCYCLOHEXYL)ETHYL) ESTER, CIS-
Common Name English
ETHANETHIOIC ACID, S-(1-METHYL-1-(4-METHYL-2-OXOCYCLOHEXYL)ETHYL) ESTER, CIS-(±)-
Common Name English
ETHANETHIOIC ACID, S-(1-METHYL-1-((1R,4S)-4-METHYL-2-OXOCYCLOHEXYL)ETHYL) ESTER, REL-
Common Name English
Code System Code Type Description
PUBCHEM
21116845
Created by admin on Sat Dec 16 00:20:57 UTC 2023 , Edited by admin on Sat Dec 16 00:20:57 UTC 2023
PRIMARY
EPA CompTox
DTXSID10168064
Created by admin on Sat Dec 16 00:20:57 UTC 2023 , Edited by admin on Sat Dec 16 00:20:57 UTC 2023
PRIMARY
FDA UNII
C5YD55048E
Created by admin on Sat Dec 16 00:20:57 UTC 2023 , Edited by admin on Sat Dec 16 00:20:57 UTC 2023
PRIMARY
CAS
166022-16-8
Created by admin on Sat Dec 16 00:20:57 UTC 2023 , Edited by admin on Sat Dec 16 00:20:57 UTC 2023
PRIMARY