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tans-2-Cyclohexyl-3-(4-pyridyl)-4-phenyl-1,2-thiazetizine 1,1-dioxide
SpectraBase Compound ID 8zzlvQMCpWB
InChI InChI=1S/C19H22N2O2S/c22-24(23)19(16-7-3-1-4-8-16)18(15-11-13-20-14-12-15)21(24)17-9-5-2-6-10-17/h1,3-4,7-8,11-14,17-19H,2,5-6,9-10H2/t18-,19-/m0/s1
InChIKey GWXVUGQNRMJKOE-OALUTQOASA-N
Mol Weight 342.46 g/mol
Molecular Formula C19H22N2O2S
Exact Mass 342.140199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1nzN1mnKOgF
Name tans-2-Cyclohexyl-3-(4-pyridyl)-4-phenyl-1,2-thiazetizine 1,1-dioxide
Alternate Name(s) 4-[(3S,4S)-2-cyclohexyl-1,1-dioxido-4-phenyl-1,2-thiazetidin-3-yl]pyridine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22N2O2S
InChI InChI=1S/C19H22N2O2S/c22-24(23)19(16-7-3-1-4-8-16)18(15-11-13-20-14-12-15)21(24)17-9-5-2-6-10-17/h1,3-4,7-8,11-14,17-19H,2,5-6,9-10H2/t18-,19-/m0/s1
InChIKey GWXVUGQNRMJKOE-OALUTQOASA-N
Molecular Weight 342.457 g/mol
SMILES C1(N2S([C@]([C@@]2(c2ccncc2)[H])(c2ccccc2)[H])(=O)=O)CCCCC1
SPLASH splash10-0002-0902000000-ff92bf95ce11982cfb7c
Source of Spectrum F-54-8957-10
Wiley ID 807933