Propanenitrile, 3-[2-(1-pyrrolyl)phenylthio]-

SpectraBase Compound ID	KgcLyle3wHk
InChI	InChI=1S/C13H12N2S/c14-8-5-11-16-13-7-2-1-6-12(13)15-9-3-4-10-15/h1-4,6-7,9-10H,5,11H2
InChIKey	CVAZQYAGDNFGSE-UHFFFAOYSA-N Google Search
Mol Weight	228.31 g/mol
Molecular Formula	C13H12N2S
Exact Mass	228.07212 g/mol

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SpectraBase Spectrum ID	8RSozjPWSse
Name	Propanenitrile, 3-[2-(1-pyrrolyl)phenylthio]-
Alternate Name(s)	3-(2-pyrrol-1-ylphenyl)sulfanylpropanenitrile 3-([2-(1H-Pyrrol-1-yl)phenyl]sulfanyl)propanenitrile 3-[(2-pyrrol-1-ylphenyl)thio]propionitrile 3-[[2-(1-Pyrrolyl)phenyl]thio]propanenitrile
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H12N2S
InChI	InChI=1S/C13H12N2S/c14-8-5-11-16-13-7-2-1-6-12(13)15-9-3-4-10-15/h1-4,6-7,9-10H,5,11H2
InChIKey	CVAZQYAGDNFGSE-UHFFFAOYSA-N
Molecular Weight	228.313 g/mol
SMILES	c1ccc(-[n]2cccc2)c(SCCC#N)c1
SPLASH	splash10-00fr-1920000000-e2559820fc6c817ad1c1
Source of Spectrum	AD-0-2532-0
Wiley ID	1428512