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(R)-2-((4-chlorophenyl)amino)-2-cyclohexyl-3,3-difluoropropanenitrile
SpectraBase Compound ID Lx7I7cMvEFm
InChI InChI=1S/C15H17ClF2N2/c16-12-6-8-13(9-7-12)20-15(10-19,14(17)18)11-4-2-1-3-5-11/h6-9,11,14,20H,1-5H2/t15-/m0/s1
InChIKey CMSMYJDNPRAOBG-HNNXBMFYSA-N
Mol Weight 298.76 g/mol
Molecular Formula C15H17ClF2N2
Exact Mass 298.104833 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kv5KwFxnluW
Name (R)-2-((4-chlorophenyl)amino)-2-cyclohexyl-3,3-difluoropropanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17ClF2N2
InChI InChI=1S/C15H17ClF2N2/c16-12-6-8-13(9-7-12)20-15(10-19,14(17)18)11-4-2-1-3-5-11/h6-9,11,14,20H,1-5H2/t15-/m0/s1
InChIKey CMSMYJDNPRAOBG-HNNXBMFYSA-N
Literature Reference DOI 10.1021/ol201316z
Molecular Weight 298.765 g/mol
SMILES N([C@@](C(F)F)(C#N)C1CCCCC1)c1ccc(cc1)Cl
SPLASH splash10-052f-9000000000-0a5ead504fb7a6f856ab
Source of Spectrum A1-13-3826/SM23-5p
Wiley ID 1753476