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methyl 5-({5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoyl}amino)-4-cyano-3-methyl-2-thiophenecarboxylate
SpectraBase Compound ID FguuoOU4ot3
InChI InChI=1S/C17H13ClN4O4S/c1-9-12(5-19)16(27-14(9)17(24)25-2)21-15(23)13-4-3-11(26-13)8-22-7-10(18)6-20-22/h3-4,6-7H,8H2,1-2H3,(H,21,23)
InChIKey OEELJJUYHQCWHJ-UHFFFAOYSA-N
Mol Weight 404.83 g/mol
Molecular Formula C17H13ClN4O4S
Exact Mass 404.034604 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FfaNmPXFql
Name methyl 5-({5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoyl}amino)-4-cyano-3-methyl-2-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/C17H13ClN4O4S/c1-9-12(5-19)16(27-14(9)17(24)25-2)21-15(23)13-4-3-11(26-13)8-22-7-10(18)6-20-22/h3-4,6-7H,8H2,1-2H3,(H,21,23)
InChIKey OEELJJUYHQCWHJ-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3697
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/8103514; UBI_ID: UBI-003698
Temperature 308 °C