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cis-1-Methyl-4-[(1-phenylsulfonyl)ethyl]cyclohexyl isocyamide

View entire compound with spectra: 1 MS (GC)

cis-1-Methyl-4-[(1-phenylsulfonyl)ethyl]cyclohexyl isocyamide
SpectraBase Compound ID IxBuScKCXQG
InChI InChI=1S/C16H21NO2S/c1-13(14-8-10-16(2,12-17)11-9-14)20(18,19)15-6-4-3-5-7-15/h3-7,13-14H,8-11H2,1-2H3/t13?,14-,16+
InChIKey YPGMOEXWLUBNKK-HACWVTTISA-N
Mol Weight 291.41 g/mol
Molecular Formula C16H21NO2S
Exact Mass 291.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qX3YTm8hDc
Name cis-1-Methyl-4-[(1-phenylsulfonyl)ethyl]cyclohexyl isocyamide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO2S
InChI InChI=1S/C16H21NO2S/c1-13(14-8-10-16(2,12-17)11-9-14)20(18,19)15-6-4-3-5-7-15/h3-7,13-14H,8-11H2,1-2H3/t13?,14-,16+
InChIKey YPGMOEXWLUBNKK-HACWVTTISA-N
Molecular Weight 291.409 g/mol
SMILES C(S(=O)(=O)c1ccccc1)([C@]1(CC[C@@](C#N)(CC1)C)[H])C
SPLASH splash10-00di-1900000000-d1653d46a347b0705ab2
Source of Spectrum K-2002-2254-9
Wiley ID 1613088