Information from the InChI

There are no matching entries in the database for this IUPAC International Chemical Identifier. The following information was obtained from the identifier.

• Formula: C₁₀H₁₈OS
• Molecular weight: 186.314
• IUPAC Standard InChI:
  • 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
• IUPAC Standard InChIKey: RVOKNSFEAOYULQ-CITRWARWSA-N
• Connectivity:
• 2-d Mol File from the identifier
• Canonical atom numbers:
  Note: stereochemistry is currently not indicated in the items above.
• Permanent link for this search. Use this link for bookmarking this species for future reference.
• Stereoisomers:
  • Cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, trans-
  • Cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, (2S-trans)-
  • Cyclohexanone, 2-(1-mercapto-1-methylethyl)-5-methyl-, (2R-cis)-

Contents of the identifier

Identifier version: 1

Main section

• Formula: C10H18OS
• Connectivity: 1-7-4-5-8(9(11)6-7)10(2,3)12
• Hydrogen: 7-8,12H,4-6H2,1-3H3
• sp³ Stereo: 7-,8
• Stereo type: 1