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4-(Phenylsulfanyl)benzonitrile
SpectraBase Compound ID 5VCe9Twx0ge
InChI InChI=1S/C13H9NS/c14-10-11-6-8-13(9-7-11)15-12-4-2-1-3-5-12/h1-9H
InChIKey BPUORBVHZGHTPR-UHFFFAOYSA-N
Mol Weight 211.28 g/mol
Molecular Formula C13H9NS
Exact Mass 211.04557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HpZQByTJWGt
Name 4-(Phenylsulfanyl)benzonitrile
Alternate Name(s) 4-(Phenylthio)benzonitrile 4-Phenylsulfanylbenzenecarbonitrile 4-Phenylsulfanylbenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9NS
InChI InChI=1S/C13H9NS/c14-10-11-6-8-13(9-7-11)15-12-4-2-1-3-5-12/h1-9H
InChIKey BPUORBVHZGHTPR-UHFFFAOYSA-N
Molecular Weight 211.282 g/mol
SMILES C(#N)c1ccc(Sc2ccccc2)cc1
SPLASH splash10-03e9-0590000000-3e12811619e5d8d01ea4
Source of Spectrum J-61-934-2
Wiley ID 1210526