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methyl 2-({[4-(2-fluorophenyl)-1-piperazinyl]carbothioyl}amino)-5-methyl-3-thiophenecarboxylate
SpectraBase Compound ID IIyhTiiFq1R
InChI InChI=1S/C18H20FN3O2S2/c1-12-11-13(17(23)24-2)16(26-12)20-18(25)22-9-7-21(8-10-22)15-6-4-3-5-14(15)19/h3-6,11H,7-10H2,1-2H3,(H,20,25)
InChIKey ZNXXXNPRIFEUKY-UHFFFAOYSA-N
Mol Weight 393.5 g/mol
Molecular Formula C18H20FN3O2S2
Exact Mass 393.098097 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AXKji3k5ap
Name methyl 2-({[4-(2-fluorophenyl)-1-piperazinyl]carbothioyl}amino)-5-methyl-3-thiophenecarboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C18H20FN3O2S2/c1-12-11-13(17(23)24-2)16(26-12)20-18(25)22-9-7-21(8-10-22)15-6-4-3-5-14(15)19/h3-6,11H,7-10H2,1-2H3,(H,20,25)
InChIKey ZNXXXNPRIFEUKY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_7376
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/1268992; Labnumber: COL4937; UZI_ID: UZI-007378
Temperature 318 °C