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1-Phenyl-2-methyl-3-(carbomethoxy-isopropyl-carbamoyl)-isothiourea
SpectraBase Compound ID BYuXjs6z40s
InChI InChI=1S/C13H19N3O4S2/c1-10(2)16(13(17)20-3)22(18,19)15-12(21-4)14-11-8-6-5-7-9-11/h5-10H,1-4H3,(H,14,15)
InChIKey LXABEDMQPCJVIB-UHFFFAOYSA-N
Mol Weight 345.43 g/mol
Molecular Formula C13H19N3O4S2
Exact Mass 345.081698 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 39ZqgRHi61Q
Name 1-Phenyl-2-methyl-3-(carbomethoxy-isopropyl-carbamoyl)-isothiourea
CAS Registry Number 79101-93-2
Comments WHE-7642-36
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H19N3O4S2
InChI InChI=1S/C13H19N3O4S2/c1-10(2)16(13(17)20-3)22(18,19)15-12(21-4)14-11-8-6-5-7-9-11/h5-10H,1-4H3,(H,14,15)
InChIKey LXABEDMQPCJVIB-UHFFFAOYSA-N
Instrument Name Bruker WM-360
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3