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methyl 6-amino-4-{3-[(3-bromophenoxy)methyl]-4-methoxyphenyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
SpectraBase Compound ID Efl7EqHaXFz
InChI InChI=1S/C23H21BrN2O5/c1-13-20(23(27)29-3)21(18(11-25)22(26)31-13)14-7-8-19(28-2)15(9-14)12-30-17-6-4-5-16(24)10-17/h4-10,21H,12,26H2,1-3H3
InChIKey PSPWVQBKYAODGE-UHFFFAOYSA-N
Mol Weight 485.33 g/mol
Molecular Formula C23H21BrN2O5
Exact Mass 484.063385 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3ekfAEccHHm
Name methyl 6-amino-4-{3-[(3-bromophenoxy)methyl]-4-methoxyphenyl}-5-cyano-2-methyl-4H-pyran-3-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/C23H21BrN2O5/c1-13-20(23(27)29-3)21(18(11-25)22(26)31-13)14-7-8-19(28-2)15(9-14)12-30-17-6-4-5-16(24)10-17/h4-10,21H,12,26H2,1-3H3
InChIKey PSPWVQBKYAODGE-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_7292
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: 9686260; UBI_ID: UBI-007295
Temperature 318 °C