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1-(2,2,2-Trichloro-1-isobutyramidoethyl)-3-(2,4,6-trichlorophenyl)-2-thiourea
SpectraBase Compound ID LbUkVVQbSp
InChI InChI=1S/C13H13Cl6N3OS/c1-5(2)10(23)21-11(13(17,18)19)22-12(24)20-9-7(15)3-6(14)4-8(9)16/h3-5,11H,1-2H3,(H,21,23)(H2,20,22,24)
InChIKey YSMVBDJUCMCDBW-UHFFFAOYSA-N
Mol Weight 472.0 g/mol
Molecular Formula C13H13Cl6N3OS
Exact Mass 468.891049 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID xLkkSIaAip
Name 1-(2,2,2-TRICHLORO-1-ISOBUTYRAMIDOETHYL)-3-(2,4,6-TRICHLOROPHENYL)-2-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H13Cl6N3OS
InChI InChI=1S/C13H13Cl6N3OS/c1-5(2)10(23)21-11(13(17,18)19)22-12(24)20-9-7(15)3-6(14)4-8(9)16/h3-5,11H,1-2H3,(H,21,23)(H2,20,22,24)
InChIKey YSMVBDJUCMCDBW-UHFFFAOYSA-N
Molecular Weight 468.8911
SMILES N(C(=S)NC(NC(C(C)C)=O)C(Cl)(Cl)Cl)c1c(Cl)cc(Cl)cc1Cl
SPLASH splash10-0006-9210000000-1e6b3179dd7130993e58
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany