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N-(N'-propyl-N-p-toluoyl-amidino)thiocarbamic acid S-methyl ester

View entire compound with spectra: 2 MS (GC)

N-(N'-propyl-N-p-toluoyl-amidino)thiocarbamic acid S-methyl ester
SpectraBase Compound ID 6ldWxUBdZj3
InChI InChI=1S/C14H19N3O2S/c1-4-9-15-13(17-14(19)20-3)16-12(18)11-7-5-10(2)6-8-11/h5-8H,4,9H2,1-3H3,(H2,15,16,17,18,19)
InChIKey YEZQZOMYAFRFPP-UHFFFAOYSA-N
Mol Weight 293.38 g/mol
Molecular Formula C14H19N3O2S
Exact Mass 293.119798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SDqmVL1UjO
Name GUANIDINE, 3-(METHYLTHIOCARBONYL)-2-N-PROPYL-1-(p-TOLUOYL)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H19N3O2S
InChI InChI=1S/C14H19N3O2S/c1-4-9-15-13(17-14(19)20-3)16-12(18)11-7-5-10(2)6-8-11/h5-8H,4,9H2,1-3H3,(H2,15,16,17,18,19)
InChIKey YEZQZOMYAFRFPP-UHFFFAOYSA-N
Instrument Name CH5
Molecular Weight 293.1194
SMILES N(\C(=N\C(c1ccc(C)cc1)=O)NCCC)C(=O)SC
SPLASH splash10-014j-7950000000-b283ed3ae0ae1d7e84ea
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany