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2-thiophenecarboxylic acid, 3-[[[4-(2-fluorophenyl)-1-piperazinyl]carbonothioyl]amino]-, methyl ester
SpectraBase Compound ID KZgS3iDE9yf
InChI InChI=1S/C17H18FN3O2S2/c1-23-16(22)15-13(6-11-25-15)19-17(24)21-9-7-20(8-10-21)14-5-3-2-4-12(14)18/h2-6,11H,7-10H2,1H3,(H,19,24)
InChIKey UJRNQADFEVXROV-UHFFFAOYSA-N
Mol Weight 379.47 g/mol
Molecular Formula C17H18FN3O2S2
Exact Mass 379.082447 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EqVnqjbbIal
Name 2-thiophenecarboxylic acid, 3-[[[4-(2-fluorophenyl)-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 379.082447341 u
Formula C17H18FN3O2S2
InChI InChI=1S/C17H18FN3O2S2/c1-23-16(22)15-13(6-11-25-15)19-17(24)21-9-7-20(8-10-21)14-5-3-2-4-12(14)18/h2-6,11H,7-10H2,1H3,(H,19,24)
InChIKey UJRNQADFEVXROV-UHFFFAOYSA-N
Molecular Weight 379.468 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_1364
Solvent DMSO-d6
Source Vendor ID: NMR/13248558