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ethyl 3-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-5-methoxy-1H-indole-2-carboxylate
SpectraBase Compound ID CuUU0K6aXlm
InChI InChI=1S/C22H20N2O6/c1-3-28-22(26)21-20(15-11-14(27-2)6-7-16(15)23-21)24-19(25)9-5-13-4-8-17-18(10-13)30-12-29-17/h4-11,23H,3,12H2,1-2H3,(H,24,25)/b9-5+
InChIKey KCSIHXOHJRWTQG-WEVVVXLNSA-N
Mol Weight 408.41 g/mol
Molecular Formula C22H20N2O6
Exact Mass 408.132136 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5mv421V96Lc
Name ethyl 3-{[(2E)-3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-5-methoxy-1H-indole-2-carboxylate
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/C22H20N2O6/c1-3-28-22(26)21-20(15-11-14(27-2)6-7-16(15)23-21)24-19(25)9-5-13-4-8-17-18(10-13)30-12-29-17/h4-11,23H,3,12H2,1-2H3,(H,24,25)/b9-5+
InChIKey KCSIHXOHJRWTQG-WEVVVXLNSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19446
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: D13734; Labnumber: SIMAK-01253; SBI_ID: SBI-019449
Synonyms ethyl 3-{[3-(1,3-benzodioxol-5-yl)-2-propenoyl]amino}-5-methoxy-1H-indole-2-carboxylate
Temperature 318 °C