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trans-1-Cyano-2-methanesulfonylcyclohexane
SpectraBase Compound ID Bie1rz5DqBq
InChI InChI=1S/C8H13NO2S/c1-12(10,11)8-5-3-2-4-7(8)6-9/h7-8H,2-5H2,1H3/t7-,8+/m0/s1
InChIKey YEBKNSOLKFTAKS-JGVFFNPUSA-N
Mol Weight 187.26 g/mol
Molecular Formula C8H13NO2S
Exact Mass 187.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FefmfHKjz9d
Name trans-1-Cyano-2-methanesulfonylcyclohexane
Alternate Name(s) (1S,2R)-2-(methylsulfonyl)cyclohexanecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO2S
InChI InChI=1S/C8H13NO2S/c1-12(10,11)8-5-3-2-4-7(8)6-9/h7-8H,2-5H2,1H3/t7-,8+/m0/s1
InChIKey YEBKNSOLKFTAKS-JGVFFNPUSA-N
Molecular Weight 187.257 g/mol
SMILES [C@@]1(S(=O)(=O)C)([C@](C#N)(CCCC1)[H])[H]
SPLASH splash10-0a60-8900000000-f0558faf4a52c5744cdf
Source of Spectrum F-48-2624-0
Wiley ID 1183661