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3-[3-(4-chlorobenzoyl)-4-hydroxy-2-(4-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
SpectraBase Compound ID 9K0SkGVYujA
InChI InChI=1S/C20H15ClN2O7/c21-13-5-1-12(2-6-13)18(26)16-17(11-3-7-14(8-4-11)23(29)30)22(10-9-15(24)25)20(28)19(16)27/h1-8,17,27H,9-10H2,(H,24,25)
InChIKey REZWJDQTDAKISV-UHFFFAOYSA-N
Mol Weight 430.8 g/mol
Molecular Formula C20H15ClN2O7
Exact Mass 430.056779 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1gJ4cbn5fOP
Name 3-[3-(4-chlorobenzoyl)-4-hydroxy-2-(4-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
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/C20H15ClN2O7/c21-13-5-1-12(2-6-13)18(26)16-17(11-3-7-14(8-4-11)23(29)30)22(10-9-15(24)25)20(28)19(16)27/h1-8,17,27H,9-10H2,(H,24,25)
InChIKey REZWJDQTDAKISV-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14772
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: C22042; Labnumber: RPGE-3778; SBI_ID: SBI-014775
Temperature 308 °C