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methyl 3-({3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]propanoyl}amino)-5-methyl-1H-indole-2-carboxylate
SpectraBase Compound ID 3ocjUeCBNLQ
InChI InChI=1S/C26H30N4O5/c1-17-3-5-20-19(13-17)24(25(27-20)26(32)33-2)28-23(31)7-8-29-9-11-30(12-10-29)15-18-4-6-21-22(14-18)35-16-34-21/h3-6,13-14,27H,7-12,15-16H2,1-2H3,(H,28,31)
InChIKey WAJHTTOSCLXREO-UHFFFAOYSA-N
Mol Weight 478.55 g/mol
Molecular Formula C26H30N4O5
Exact Mass 478.22162 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9YKMEbEhsnt
Name methyl 3-({3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]propanoyl}amino)-5-methyl-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/C26H30N4O5/c1-17-3-5-20-19(13-17)24(25(27-20)26(32)33-2)28-23(31)7-8-29-9-11-30(12-10-29)15-18-4-6-21-22(14-18)35-16-34-21/h3-6,13-14,27H,7-12,15-16H2,1-2H3,(H,28,31)
InChIKey WAJHTTOSCLXREO-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_11501
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: 802242; Labnumber: PRBS40-30114; VK_ID: VK-011506
Temperature 313 °C