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ethyl 5-(aminocarbonyl)-2-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-4-methyl-3-thiophenecarboxylate
SpectraBase Compound ID 6aw5tbcgSPI
InChI InChI=1S/C19H18N2O6S/c1-3-25-19(24)15-10(2)16(17(20)23)28-18(15)21-14(22)7-5-11-4-6-12-13(8-11)27-9-26-12/h4-8H,3,9H2,1-2H3,(H2,20,23)(H,21,22)/b7-5+
InChIKey TWAWIPZISMUIEY-FNORWQNLSA-N
Mol Weight 402.42 g/mol
Molecular Formula C19H18N2O6S
Exact Mass 402.088557 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6zDVqUGfmTB
Name ethyl 5-(aminocarbonyl)-2-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-4-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/C19H18N2O6S/c1-3-25-19(24)15-10(2)16(17(20)23)28-18(15)21-14(22)7-5-11-4-6-12-13(8-11)27-9-26-12/h4-8H,3,9H2,1-2H3,(H2,20,23)(H,21,22)/b7-5+
InChIKey TWAWIPZISMUIEY-FNORWQNLSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_13798
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/8132125; Labnumber: NSB0043367; UZI_ID: UZI-013802
Synonyms ethyl 5-(aminocarbonyl)-2-{[3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-4-methyl-3-thiophenecarboxylate
Temperature 318 °C