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Acetamide, N-[2-(2-pyridinylthio)cyclohexyl]-, trans-
SpectraBase Compound ID H5JunzL8tEx
InChI InChI=1S/C13H18N2OS/c1-10(16)15-11-6-2-3-7-12(11)17-13-8-4-5-9-14-13/h4-5,8-9,11-12H,2-3,6-7H2,1H3,(H,15,16)/t11-,12-/m1/s1
InChIKey GFMCLQBATPXXBK-VXGBXAGGSA-N
Mol Weight 250.36 g/mol
Molecular Formula C13H18N2OS
Exact Mass 250.113984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4nQyjpc7Zn2
Name Acetamide, N-[2-(2-pyridinylthio)cyclohexyl]-, trans-
CAS Registry Number 98154-84-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2OS
InChI InChI=1S/C13H18N2OS/c1-10(16)15-11-6-2-3-7-12(11)17-13-8-4-5-9-14-13/h4-5,8-9,11-12H,2-3,6-7H2,1H3,(H,15,16)/t11-,12-/m1/s1
InChIKey GFMCLQBATPXXBK-VXGBXAGGSA-N
Molecular Weight 250.360 g/mol
SMILES N(C(=O)C)[C@]1([C@](Sc2ncccc2)(CCCC1)[H])[H]
SPLASH splash10-03dl-0910000000-b148409d187a7d0e647d
Source of Spectrum KC-1985-1036-4
Synonyms N-[(1R,2R)-2-(2-pyridinylsulfanyl)cyclohexyl]acetamide trans-1-acetamido-2-(2-pyridylthio)cyclohexane
Wiley ID 1253137