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2H-1-benzopyran-2-one, 3-(3,4-dimethoxyphenyl)-8-[(hexahydro-1H-azepin-1-yl)methyl]-7-hydroxy-4-methyl-
SpectraBase Compound ID 5HXoX3P5joV
InChI InChI=1S/C25H29NO5/c1-16-18-9-10-20(27)19(15-26-12-6-4-5-7-13-26)24(18)31-25(28)23(16)17-8-11-21(29-2)22(14-17)30-3/h8-11,14,27H,4-7,12-13,15H2,1-3H3
InChIKey YRJDRQQMQXYMGW-UHFFFAOYSA-N
Mol Weight 423.51 g/mol
Molecular Formula C25H29NO5
Exact Mass 423.204573 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IdCPRXzJr6d
Name 2H-1-benzopyran-2-one, 3-(3,4-dimethoxyphenyl)-8-[(hexahydro-1H-azepin-1-yl)methyl]-7-hydroxy-4-methyl-
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/C25H29NO5/c1-16-18-9-10-20(27)19(15-26-12-6-4-5-7-13-26)24(18)31-25(28)23(16)17-8-11-21(29-2)22(14-17)30-3/h8-11,14,27H,4-7,12-13,15H2,1-3H3
InChIKey YRJDRQQMQXYMGW-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_5448
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: F25603; Labnumber: ExLab-N0207-0211