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3-[3-(4-chlorobenzoyl)-2-(3-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoic acid
SpectraBase Compound ID Aco8W616L4u
InChI InChI=1S/C20H15ClFNO5/c21-13-6-4-11(5-7-13)18(26)16-17(12-2-1-3-14(22)10-12)23(9-8-15(24)25)20(28)19(16)27/h1-7,10,17,27H,8-9H2,(H,24,25)
InChIKey LMAPSXZOBXTULV-UHFFFAOYSA-N
Mol Weight 403.79 g/mol
Molecular Formula C20H15ClFNO5
Exact Mass 403.062278 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LOmst5Wyhe8
Name 3-[3-(4-chlorobenzoyl)-2-(3-fluorophenyl)-4-hydroxy-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/C20H15ClFNO5/c21-13-6-4-11(5-7-13)18(26)16-17(12-2-1-3-14(22)10-12)23(9-8-15(24)25)20(28)19(16)27/h1-7,10,17,27H,8-9H2,(H,24,25)
InChIKey LMAPSXZOBXTULV-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14774
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: C22046; Labnumber: RPGE-3782; SBI_ID: SBI-014777
Temperature 308 °C