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1,4-benzenedicarboxylic acid, 2-[[(4-ethyl-1-piperazinyl)carbonothioyl]amino]-, dimethyl ester
SpectraBase Compound ID 9y9MCeBV0zg
InChI InChI=1S/C17H23N3O4S/c1-4-19-7-9-20(10-8-19)17(25)18-14-11-12(15(21)23-2)5-6-13(14)16(22)24-3/h5-6,11H,4,7-10H2,1-3H3,(H,18,25)
InChIKey LNYORWBKWKWCQM-UHFFFAOYSA-N
Mol Weight 365.45 g/mol
Molecular Formula C17H23N3O4S
Exact Mass 365.140927 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GAAMRXt9ANh
Name 1,4-benzenedicarboxylic acid, 2-[[(4-ethyl-1-piperazinyl)carbonothioyl]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 365.140927403 u
Formula C17H23N3O4S
InChI InChI=1S/C17H23N3O4S/c1-4-19-7-9-20(10-8-19)17(25)18-14-11-12(15(21)23-2)5-6-13(14)16(22)24-3/h5-6,11H,4,7-10H2,1-3H3,(H,18,25)
InChIKey LNYORWBKWKWCQM-UHFFFAOYSA-N
Molecular Weight 365.448 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1352
Solvent DMSO-d6
Source Vendor ID: NMR/13248535