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trans-2-Cyclohexyl-3-(4-methylphenyl)-4-methyl-1,2-thiazetizine 1,1-dioxide
SpectraBase Compound ID Lkzg7OflS9X
InChI InChI=1S/C16H23NO2S/c1-12-8-10-14(11-9-12)16-13(2)20(18,19)17(16)15-6-4-3-5-7-15/h8-11,13,15-16H,3-7H2,1-2H3/t13-,16+/m0/s1
InChIKey CNVIHKSTUYGGNR-XJKSGUPXSA-N
Mol Weight 293.43 g/mol
Molecular Formula C16H23NO2S
Exact Mass 293.14495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IE3AjECiYSb
Name trans-2-Cyclohexyl-3-(4-methylphenyl)-4-methyl-1,2-thiazetizine 1,1-dioxide
Alternate Name(s) (3S,4S)-2-cyclohexyl-4-methyl-3-(4-methylphenyl)-1,2-thiazetidine 1,1-dioxide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO2S
InChI InChI=1S/C16H23NO2S/c1-12-8-10-14(11-9-12)16-13(2)20(18,19)17(16)15-6-4-3-5-7-15/h8-11,13,15-16H,3-7H2,1-2H3/t13-,16+/m0/s1
InChIKey CNVIHKSTUYGGNR-XJKSGUPXSA-N
Molecular Weight 293.425 g/mol
SMILES C1(N2S([C@]([C@@]2(c2ccc(cc2)C)[H])(C)[H])(=O)=O)CCCCC1
SPLASH splash10-001i-0910000000-c116c4e15da9cf8b5811
Source of Spectrum F-54-8656-1
Wiley ID 807940