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methyl 3-({[1,3-benzodioxol-5-yl(ethyl)amino]acetyl}amino)-1H-indole-2-carboxylate
SpectraBase Compound ID F8LrMbJSg6H
InChI InChI=1S/C21H21N3O5/c1-3-24(13-8-9-16-17(10-13)29-12-28-16)11-18(25)23-19-14-6-4-5-7-15(14)22-20(19)21(26)27-2/h4-10,22H,3,11-12H2,1-2H3,(H,23,25)
InChIKey XCQSYRBNQJAORO-UHFFFAOYSA-N
Mol Weight 395.42 g/mol
Molecular Formula C21H21N3O5
Exact Mass 395.148121 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BzAloQmTRS5
Name methyl 3-({[1,3-benzodioxol-5-yl(ethyl)amino]acetyl}amino)-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/C21H21N3O5/c1-3-24(13-8-9-16-17(10-13)29-12-28-16)11-18(25)23-19-14-6-4-5-7-15(14)22-20(19)21(26)27-2/h4-10,22H,3,11-12H2,1-2H3,(H,23,25)
InChIKey XCQSYRBNQJAORO-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_11359
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: 802168; Labnumber: PRBS2-10091; VK_ID: VK-011364
Temperature 313 °C