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N-(2-Phenylbutanoyl)thiourea
SpectraBase Compound ID 4xSeT9Nkno
InChI InChI=1S/C11H14N2OS/c1-2-9(10(14)13-11(12)15)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H3,12,13,14,15)
InChIKey LRMMKKGSIVWOHG-UHFFFAOYSA-N
Mol Weight 222.31 g/mol
Molecular Formula C11H14N2OS
Exact Mass 222.082684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CDCGscVSzML
Name N-(2-Phenylbutanoyl)thiourea
Alternate Name(s) (2-Phenyl-butanoyl)thiourea 2-Phenyl-N-thiocarbamoyl-butyramide N-carbamothioyl-2-phenyl-butanamide
CAS Registry Number 92491-16-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14N2OS
InChI InChI=1S/C11H14N2OS/c1-2-9(10(14)13-11(12)15)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H3,12,13,14,15)
InChIKey LRMMKKGSIVWOHG-UHFFFAOYSA-N
Molecular Weight 222.306 g/mol
SMILES N\C(=N\C(C(CC)c1ccccc1)=O)S
SPLASH splash10-0002-0900000000-e3c7fee8f2b3536d98c1
Source of Spectrum O-22-110-12
Wiley ID 1222009