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trans-6-Allyl-1-phenyl-4-(1-nitrocyclohexyl)piperidine-2-thione
SpectraBase Compound ID AJWtICIotY9
InChI InChI=1S/C20H26N2O2S/c1-2-9-18-14-16(20(22(23)24)12-7-4-8-13-20)15-19(25)21(18)17-10-5-3-6-11-17/h2-3,5-6,10-11,16,18H,1,4,7-9,12-15H2/t16-,18-/m1/s1
InChIKey VGRUFQFISHNLPS-SJLPKXTDSA-N
Mol Weight 358.5 g/mol
Molecular Formula C20H26N2O2S
Exact Mass 358.171499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IJQ6jAwd7yy
Name trans-6-Allyl-1-phenyl-4-(1-nitrocyclohexyl)piperidine-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26N2O2S
InChI InChI=1S/C20H26N2O2S/c1-2-9-18-14-16(20(22(23)24)12-7-4-8-13-20)15-19(25)21(18)17-10-5-3-6-11-17/h2-3,5-6,10-11,16,18H,1,4,7-9,12-15H2/t16-,18-/m1/s1
InChIKey VGRUFQFISHNLPS-SJLPKXTDSA-N
Molecular Weight 358.500 g/mol
SMILES C1(N([C@](CC=C)(C[C@@](C2(N(=O)=O)CCCCC2)(C1)[H])[H])c1ccccc1)=S
SPLASH splash10-03fr-5579000000-75c550123faba00f8a34
Source of Spectrum F-65-1344-5k
Wiley ID 1681849