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1H-pyrrole-3-carboxylic acid, 4-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-4,5-dihydro-1-(3-methoxyphenyl)-2-methyl-5-oxo-, methyl ester, (4Z)-

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1H-pyrrole-3-carboxylic acid, 4-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-4,5-dihydro-1-(3-methoxyphenyl)-2-methyl-5-oxo-, methyl ester, (4Z)-
SpectraBase Compound ID 1ftQFNp1MJG
InChI InChI=1S/C22H18BrNO6/c1-12-20(22(26)28-3)16(7-13-8-18-19(10-17(13)23)30-11-29-18)21(25)24(12)14-5-4-6-15(9-14)27-2/h4-10H,11H2,1-3H3/b16-7-
InChIKey VGMYNOFONMVLPP-APSNUPSMSA-N
Mol Weight 472.29 g/mol
Molecular Formula C22H18BrNO6
Exact Mass 471.03175 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7qVBVsMczg4
Name 1H-pyrrole-3-carboxylic acid, 4-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-4,5-dihydro-1-(3-methoxyphenyl)-2-methyl-5-oxo-, methyl ester, (4Z)-
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/C22H18BrNO6/c1-12-20(22(26)28-3)16(7-13-8-18-19(10-17(13)23)30-11-29-18)21(25)24(12)14-5-4-6-15(9-14)27-2/h4-10H,11H2,1-3H3/b16-7-
InChIKey VGMYNOFONMVLPP-APSNUPSMSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_1692
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/11229774