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benzoic acid, 3-[[(2E)-2-[[(5-bromo-2-furanyl)carbonyl]amino]-3-(3-nitrophenyl)-1-oxo-2-propenyl]amino]-, methyl ester
SpectraBase Compound ID Kv9RL7oC9PV
InChI InChI=1S/C22H16BrN3O7/c1-32-22(29)14-5-3-6-15(12-14)24-20(27)17(25-21(28)18-8-9-19(23)33-18)11-13-4-2-7-16(10-13)26(30)31/h2-12H,1H3,(H,24,27)(H,25,28)/b17-11+
InChIKey BQCZEGUEHFIDFL-GZTJUZNOSA-N
Mol Weight 514.29 g/mol
Molecular Formula C22H16BrN3O7
Exact Mass 513.017163 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BovkTmVP2LU
Name benzoic acid, 3-[[(2E)-2-[[(5-bromo-2-furanyl)carbonyl]amino]-3-(3-nitrophenyl)-1-oxo-2-propenyl]amino]-, methyl ester
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/C22H16BrN3O7/c1-32-22(29)14-5-3-6-15(12-14)24-20(27)17(25-21(28)18-8-9-19(23)33-18)11-13-4-2-7-16(10-13)26(30)31/h2-12H,1H3,(H,24,27)(H,25,28)/b17-11+
InChIKey BQCZEGUEHFIDFL-GZTJUZNOSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_69
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/10318303