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2-thiophenecarboxylic acid, 3-[[[4-(2-hydroxyethyl)-1-piperazinyl]carbonothioyl]amino]-, methyl ester
SpectraBase Compound ID LsRRwTOSLRq
InChI InChI=1S/C13H19N3O3S2/c1-19-12(18)11-10(2-9-21-11)14-13(20)16-5-3-15(4-6-16)7-8-17/h2,9,17H,3-8H2,1H3,(H,14,20)
InChIKey NFCRVUCEUSSUHO-UHFFFAOYSA-N
Mol Weight 329.43 g/mol
Molecular Formula C13H19N3O3S2
Exact Mass 329.086784 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5WcEmvBhFB8
Name 2-thiophenecarboxylic acid, 3-[[[4-(2-hydroxyethyl)-1-piperazinyl]carbonothioyl]amino]-, methyl 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 329.086783829 u
Formula C13H19N3O3S2
InChI InChI=1S/C13H19N3O3S2/c1-19-12(18)11-10(2-9-21-11)14-13(20)16-5-3-15(4-6-16)7-8-17/h2,9,17H,3-8H2,1H3,(H,14,20)
InChIKey NFCRVUCEUSSUHO-UHFFFAOYSA-N
Molecular Weight 329.433 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1370
Solvent DMSO-d6
Source Vendor ID: NMR/13248564