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N-(2-Chlorophenyl)-N'-(4-cyanobenzyl)thiourea
SpectraBase Compound ID 75NSwNRMp8Q
InChI InChI=1S/C15H12ClN3S/c16-13-3-1-2-4-14(13)19-15(20)18-10-12-7-5-11(9-17)6-8-12/h1-8H,10H2,(H2,18,19,20)
InChIKey LPDJUEATYKDPGU-UHFFFAOYSA-N
Mol Weight 301.79 g/mol
Molecular Formula C15H12ClN3S
Exact Mass 301.044046 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J24X72aOert
Name N-(2-Chlorophenyl)-N'-(4-cyanobenzyl)thiourea
Alternate Name(s) 1-(2-Chlorophenyl)-3-(4-cyanobenzyl)thiourea 1-(2-Chlorophenyl)-3-[(4-cyanophenyl)methyl]thiourea Benzonitrile, 4-[3-(2-chlorophenyl)-1-thioureidomethyl]-
CAS Registry Number 261964-38-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12ClN3S
InChI InChI=1S/C15H12ClN3S/c16-13-3-1-2-4-14(13)19-15(20)18-10-12-7-5-11(9-17)6-8-12/h1-8H,10H2,(H2,18,19,20)
InChIKey LPDJUEATYKDPGU-UHFFFAOYSA-N
Molecular Weight 301.795 g/mol
SMILES N(C(=S)NCc1ccc(C#N)cc1)c1c(Cl)cccc1
SPLASH splash10-014i-4930000000-299f9b6f2b3bb6ff46c6
Source of Spectrum AD-0-2532-0
Wiley ID 1424746