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THIOPHANATE METHYL

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

THIOPHANATE METHYL
SpectraBase Compound ID 6ZTXLIESUnA
InChI InChI=1S/C12H14N4O4S2/c1-19-11(17)15-9(21)13-7-5-3-4-6-8(7)14-10(22)16-12(18)20-2/h3-6H,1-2H3,(H2,13,15,17,21)(H2,14,16,18,22)
InChIKey QGHREAKMXXNCOA-UHFFFAOYSA-N
Mol Weight 342.39 g/mol
Molecular Formula C12H14N4O4S2
Exact Mass 342.045647 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JfsB7Bfs7DM
Name 3,3'-(2-Phenylenebis)-dithiourea-1,1'-dicarboxyl ic acid, dimethyl ester
CAS Registry Number 23564-05-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H14N4O4S2
InChI InChI=1S/C12H14N4O4S2/c1-19-11(17)15-9(21)13-7-5-3-4-6-8(7)14-10(22)16-12(18)20-2/h3-6H,1-2H3,(H2,13,15,17,21)(H2,14,16,18,22)
InChIKey QGHREAKMXXNCOA-UHFFFAOYSA-N
Instrument Name Bruker AM-270
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6