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4-(4-bromobenzoyl)-1-(3-(dimethylammonio)propyl)-5-(4-methoxyphenyl)-2-oxo-2,5-dihydro-1H-pyrrol-3-olate
SpectraBase Compound ID ALu230F3Ejd
InChI InChI=1S/C23H25BrN2O4/c1-25(2)13-4-14-26-20(15-7-11-18(30-3)12-8-15)19(22(28)23(26)29)21(27)16-5-9-17(24)10-6-16/h5-12,20,28H,4,13-14H2,1-3H3
InChIKey NKNYDZNVDJLXKB-UHFFFAOYSA-N
Mol Weight 473.37 g/mol
Molecular Formula C23H25BrN2O4
Exact Mass 472.09977 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 64dQug9ESpc
Name 4-(4-bromobenzoyl)-1-(3-(dimethylammonio)propyl)-5-(4-methoxyphenyl)-2-oxo-2,5-dihydro-1H-pyrrol-3-olate
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/c1-25(2)13-4-14-26-20(15-7-11-18(30-3)12-8-15)19(22(28)23(26)29)21(27)16-5-9-17(24)10-6-16/h5-12,20,28H,4,13-14H2,1-3H3
InChIKey NKNYDZNVDJLXKB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_1921
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/11268365