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2H-1-benzopyran-8-methanaminium, 4,7-dihydroxy-N,N-bis(2-methoxyethyl)-3-(2-methoxyphenyl)-2-oxo-, chloride
SpectraBase Compound ID EWzfO6hz1A5
InChI InChI=1S/C23H27NO7.ClH/c1-28-12-10-24(11-13-29-2)14-17-18(25)9-8-16-21(26)20(23(27)31-22(16)17)15-6-4-5-7-19(15)30-3;/h4-9,25-26H,10-14H2,1-3H3;1H
InChIKey XKQFICOINVGBFG-UHFFFAOYSA-N
Mol Weight 465.93 g/mol
Molecular Formula C23H28ClNO7
Exact Mass 465.15543 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 95htA643E06
Name 2H-1-benzopyran-8-methanaminium, 4,7-dihydroxy-N,N-bis(2-methoxyethyl)-3-(2-methoxyphenyl)-2-oxo-, 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/C23H27NO7.ClH/c1-28-12-10-24(11-13-29-2)14-17-18(25)9-8-16-21(26)20(23(27)31-22(16)17)15-6-4-5-7-19(15)30-3;/h4-9,25-26H,10-14H2,1-3H3;1H
InChIKey XKQFICOINVGBFG-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_5452
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: F25609; Labnumber: ExLab-N0207-0246