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5-(Benzylimino)-5-(thiophen-2-yl)pentanenitrile
SpectraBase Compound ID ICiXkS3pgfu
InChI InChI=1S/C16H16N2S/c17-11-5-4-9-15(16-10-6-12-19-16)18-13-14-7-2-1-3-8-14/h1-3,6-8,10,12H,4-5,9,13H2/b18-15+
InChIKey WYWRZYMQJASGCB-OBGWFSINSA-N
Mol Weight 268.38 g/mol
Molecular Formula C16H16N2S
Exact Mass 268.10342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KCMCmi672GA
Name 5-(Benzylimino)-5-(thiophen-2-yl)pentanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N2S
InChI InChI=1S/C16H16N2S/c17-11-5-4-9-15(16-10-6-12-19-16)18-13-14-7-2-1-3-8-14/h1-3,6-8,10,12H,4-5,9,13H2/b18-15+
InChIKey WYWRZYMQJASGCB-OBGWFSINSA-N
Literature Reference DOI 10.1002/anie.201302460
Molecular Weight 268.378 g/mol
SMILES c1(\C(=N\Cc2ccccc2)CCCC#N)cccs1
SPLASH splash10-0007-9700000000-d959a99de69523f60a05
Source of Spectrum ACI-52-SMS7-1k
Synonyms (E)-5-(benzylimino)-5-(thiophen-2-yl)pentanenitrile
Wiley ID 1781497