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Cyclohexanol, 2-[(2-aminophenyl)thio]-, trans-
SpectraBase Compound ID 6K7UcjVU8U0
InChI InChI=1S/C12H17NOS/c13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14/h1,3,5,7,10,12,14H,2,4,6,8,13H2/t10-,12-/m0/s1
InChIKey LLKIGPGOZQEUOL-JQWIXIFHSA-N
Mol Weight 223.33 g/mol
Molecular Formula C12H17NOS
Exact Mass 223.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HjGhveSnrmW
Name Cyclohexanol, 2-[(2-aminophenyl)thio]-, trans-
CAS Registry Number 98793-11-4
Comments Less than 3 mono-isotopic peaks
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Formula C12H17NOS
InChI InChI=1S/C12H17NOS/c13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)14/h1,3,5,7,10,12,14H,2,4,6,8,13H2/t10-,12-/m0/s1
InChIKey LLKIGPGOZQEUOL-JQWIXIFHSA-N
Molecular Weight 223.334 g/mol
SMILES Nc1c(S[C@@]2([C@](CCCC2)(O)[H])[H])cccc1
SPLASH splash10-004i-0920000000-4206da3da0af5b8e5063
Source of Spectrum KC-1985-1047-8
Synonyms (1S,2S)-2-[(2-aminophenyl)sulfanyl]cyclohexanol 2-(2'-Aminophenylthio)cyclohexanol
Wiley ID 1223965