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methyl 3-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-2-thiophenecarboxylate
SpectraBase Compound ID 876z6OOroIa
InChI InChI=1S/C16H13NO5S/c1-20-16(19)15-11(6-7-23-15)17-14(18)5-3-10-2-4-12-13(8-10)22-9-21-12/h2-8H,9H2,1H3,(H,17,18)/b5-3+
InChIKey NJRVMKSHEFXPFK-HWKANZROSA-N
Mol Weight 331.34 g/mol
Molecular Formula C16H13NO5S
Exact Mass 331.051444 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9yX9l40kg1J
Name methyl 3-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-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/C16H13NO5S/c1-20-16(19)15-11(6-7-23-15)17-14(18)5-3-10-2-4-12-13(8-10)22-9-21-12/h2-8H,9H2,1H3,(H,17,18)/b5-3+
InChIKey NJRVMKSHEFXPFK-HWKANZROSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10636
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/9074660; UBI_ID: UBI-010639
Synonyms methyl 3-{[3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-2-thiophenecarboxylate
Temperature 313 °C