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(E)-1-Cyano-1-phenyl-2-(p-tolythio)ethene
SpectraBase Compound ID KiLCz3XZW4w
InChI InChI=1S/C16H13NS/c1-13-7-9-16(10-8-13)18-12-15(11-17)14-5-3-2-4-6-14/h2-10,12H,1H3/b15-12-
InChIKey UVTKXFSMWJYPOK-QINSGFPZSA-N
Mol Weight 251.35 g/mol
Molecular Formula C16H13NS
Exact Mass 251.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1v1fsYHFhOc
Name (E)-1-Cyano-1-phenyl-2-(p-tolythio)ethene
Alternate Name(s) (2E)-3-[(4-methylphenyl)sulfanyl]-2-phenyl-2-propenenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13NS
InChI InChI=1S/C16H13NS/c1-13-7-9-16(10-8-13)18-12-15(11-17)14-5-3-2-4-6-14/h2-10,12H,1H3/b15-12-
InChIKey UVTKXFSMWJYPOK-QINSGFPZSA-N
Molecular Weight 251.347 g/mol
SMILES c1(S\C=C\(C#N)c2ccccc2)ccc(cc1)C
SPLASH splash10-0bvi-0900000000-56fd3e64a290b0f54768
Source of Spectrum KC-1975-984-5
Wiley ID 1254711