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Substance Name: Menthone-8-thioacetate, (1R,4S)-
RN: 57129-12-1
UNII: 3QMX06VZ0C
InChIKey: AMXPURQVAMENCC-WCBMZHEXSA-N

Classification Code

  • TSCA Flag PMN (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C12-H20-O2-S

Molecular Weight

  • 228.354
 
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Names and Synonyms

Name of Substance

  • Menthone-8-thioacetate, (1R,4S)-

Synonyms

  • EINECS 260-576-6
  • UNII-3QMX06VZ0C

Systematic Names

  • Ethanethioic acid, S-(1-methyl-1-((1R,4S)-4-methyl-2-oxocyclohexyl)ethyl) ester
  • Ethanethioic acid, S-(1-methyl-1-(4-methyl-2-oxocyclohexyl)ethyl) ester, (1theta-cis)-
  • S-(1-Methyl-1-(4-methyl-2-oxocyclohexyl)ethyl) (1R-cis)-ethanethioate

Registry Numbers

CAS Registry Number

  • 57129-12-1

FDA UNII

  • 3QMX06VZ0C

System Generated Number

  • 0057129121

Structure Descriptors

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

InChIKey

AMXPURQVAMENCC-WCBMZHEXSA-N

Smiles

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