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Benzonitrile, 4-[2-(phenylthio)ethyl]-
SpectraBase Compound ID HxUkUUCJiEt
InChI InChI=1S/C15H13NS/c16-12-14-8-6-13(7-9-14)10-11-17-15-4-2-1-3-5-15/h1-9H,10-11H2
InChIKey XKAQRSXAHHGYLY-UHFFFAOYSA-N
Mol Weight 239.34 g/mol
Molecular Formula C15H13NS
Exact Mass 239.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ihv8MjDGTY
Name Benzonitrile, 4-[2-(phenylthio)ethyl]-
CAS Registry Number 108717-94-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13NS
InChI InChI=1S/C15H13NS/c16-12-14-8-6-13(7-9-14)10-11-17-15-4-2-1-3-5-15/h1-9H,10-11H2
InChIKey XKAQRSXAHHGYLY-UHFFFAOYSA-N
Molecular Weight 239.336 g/mol
SMILES C(#N)c1ccc(cc1)CCSc1ccccc1
SPLASH splash10-00di-2900000000-4dfc17993f06d32f7399
Source of Spectrum J-56-594-5
Synonyms Benzonitrile, p-[2-(phenylthio)ethyl]- 1-(4-Cyanophenyl)-2-(phenylthio)ethane 4-(2-Phenylsulfanylethyl)benzenecarbonitrile 4-[2-(Phenylsulfanyl)ethyl]benzonitrile 4-[2-(Phenylthio)ethyl]benzonitrile
Wiley ID 1242085