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Butanenitrile, 3-hydroxy-4-[(4-methylphenyl)thio]-
SpectraBase Compound ID CumPtB2Dlde
InChI InChI=1S/C11H13NOS/c1-9-2-4-11(5-3-9)14-8-10(13)6-7-12/h2-5,10,13H,6,8H2,1H3
InChIKey TVDRIOSPDCEUAJ-UHFFFAOYSA-N
Mol Weight 207.29 g/mol
Molecular Formula C11H13NOS
Exact Mass 207.071785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KysItnkYxBI
Name Butanenitrile, 3-hydroxy-4-[(4-methylphenyl)thio]-
Alternate Name(s) Butyronitrile, 3-hydroxy-4-p-tolylthio- 3-Hydroxy-4-(4-methylphenylthio)butanenitrile 3-Hydroxy-4-p-tolylthiobutanenitrile 3-Hydroxy-4-[(4-methylphenyl)sulfanyl]butanenitrile 3-Hydroxy-4-[(4-methylphenyl)thio]butanenitrile 3-Hydroxy-4-(4-methylphenyl)sulfanylbutanenitrile 3-Hydroxy-4-(p-tolylsulfanyl)butanenitrile 4-(4-Methylphenyl)sulfanyl-3-oxidanyl-butanenitrile
CAS Registry Number 108078-47-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NOS
InChI InChI=1S/C11H13NOS/c1-9-2-4-11(5-3-9)14-8-10(13)6-7-12/h2-5,10,13H,6,8H2,1H3
InChIKey TVDRIOSPDCEUAJ-UHFFFAOYSA-N
Molecular Weight 207.291 g/mol
SMILES OC(CSc1ccc(cc1)C)CC#N
SPLASH splash10-000i-0930000000-2a9752fe87b3104f934f
Source of Spectrum KC-1988-2526-18
Wiley ID 1205650