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4-{[6-bromo-3-(ethoxycarbonyl)-5-hydroxy-2-methyl-1-phenyl-1H-indol-4-yl]methyl}morpholin-4-ium chloride
SpectraBase Compound ID 7i4nrqRgcCQ
InChI InChI=1S/C23H25BrN2O4.ClH/c1-3-30-23(28)20-15(2)26(16-7-5-4-6-8-16)19-13-18(24)22(27)17(21(19)20)14-25-9-11-29-12-10-25;/h4-8,13,27H,3,9-12,14H2,1-2H3;1H
InChIKey SKMDREHFXDCGDC-UHFFFAOYSA-N
Mol Weight 509.83 g/mol
Molecular Formula C23H26BrClN2O4
Exact Mass 508.076448 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cv1zieLl1id
Name 4-{[6-bromo-3-(ethoxycarbonyl)-5-hydroxy-2-methyl-1-phenyl-1H-indol-4-yl]methyl}morpholin-4-ium chloride
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/C23H25BrN2O4.ClH/c1-3-30-23(28)20-15(2)26(16-7-5-4-6-8-16)19-13-18(24)22(27)17(21(19)20)14-25-9-11-29-12-10-25;/h4-8,13,27H,3,9-12,14H2,1-2H3;1H
InChIKey SKMDREHFXDCGDC-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_615
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: NMR/8267187; Labnumber: JMR-0001597