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1-(2-cyanophenyl)-3-(4-methylphenyl)urea
SpectraBase Compound ID BpvU1Zozx8
InChI InChI=1S/C15H13N3O/c1-11-6-8-13(9-7-11)17-15(19)18-14-5-3-2-4-12(14)10-16/h2-9H,1H3,(H2,17,18,19)
InChIKey PVKGCKRWSHHMSO-UHFFFAOYSA-N
Mol Weight 251.29 g/mol
Molecular Formula C15H13N3O
Exact Mass 251.105862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DqQhtSltFdp
Name 1-(2-cyanophenyl)-3-(4-methylphenyl)urea
Alternate Name(s) 1-(2-cyanophenyl)-3-(p-tolyl)urea
CAS Registry Number 100184-21-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13N3O
InChI InChI=1S/C15H13N3O/c1-11-6-8-13(9-7-11)17-15(19)18-14-5-3-2-4-12(14)10-16/h2-9H,1H3,(H2,17,18,19)
InChIKey PVKGCKRWSHHMSO-UHFFFAOYSA-N
Molecular Weight 251.289 g/mol
SMILES N(C(Nc1ccc(cc1)C)=O)c1c(C#N)cccc1
SPLASH splash10-066r-1900000000-06f0e3503b0cceec1f79
Source of Spectrum F-45-4281-22
Wiley ID 1254632