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4-((E)-{[Cyano(cyclohexyl)methyl]imino}methyl)benzonitrile
SpectraBase Compound ID GaSTYMvPL2z
InChI InChI=1S/C16H17N3/c17-10-13-6-8-14(9-7-13)12-19-16(11-18)15-4-2-1-3-5-15/h6-9,12,15-16H,1-5H2/b19-12+
InChIKey KUPVRVHQADVEMG-XDHOZWIPSA-N
Mol Weight 251.33 g/mol
Molecular Formula C16H17N3
Exact Mass 251.142248 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EIR26UeorU1
Name 4-((E)-{[Cyano(cyclohexyl)methyl]imino}methyl)benzonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C16H17N3
InChI InChI=1S/C16H17N3/c17-10-13-6-8-14(9-7-13)12-19-16(11-18)15-4-2-1-3-5-15/h6-9,12,15-16H,1-5H2/b19-12+
InChIKey KUPVRVHQADVEMG-XDHOZWIPSA-N
Molecular Weight 251.333 g/mol
SMILES C(\N=C\c1ccc(C#N)cc1)(C#N)C1CCCCC1
SPLASH splash10-0udi-0090000000-740bc2f83df3569ec1b5
Source of Spectrum F4-44-751-3g
Wiley ID 1706935