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1,4-benzenedicarboxylic acid, 2-[(1-pyrrolidinylcarbonothioyl)amino]-, dimethyl ester
SpectraBase Compound ID GqN07zK6OBU
InChI InChI=1S/C15H18N2O4S/c1-20-13(18)10-5-6-11(14(19)21-2)12(9-10)16-15(22)17-7-3-4-8-17/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,22)
InChIKey GSONYZPMJCWOJU-UHFFFAOYSA-N
Mol Weight 322.38 g/mol
Molecular Formula C15H18N2O4S
Exact Mass 322.098728 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5O9Zv49vWji
Name 1,4-benzenedicarboxylic acid, 2-[(1-pyrrolidinylcarbonothioyl)amino]-, dimethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.098728238 u
Formula C15H18N2O4S
InChI InChI=1S/C15H18N2O4S/c1-20-13(18)10-5-6-11(14(19)21-2)12(9-10)16-15(22)17-7-3-4-8-17/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,22)
InChIKey GSONYZPMJCWOJU-UHFFFAOYSA-N
Molecular Weight 322.379 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1024
Solvent DMSO-d6
Source Vendor ID: NMR/13239609