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acetic acid, [4-[3-benzoyl-2-(3-fluorophenyl)-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-1-yl]phenoxy]-
SpectraBase Compound ID In3R03A1Swq
InChI InChI=1S/C25H18FNO6/c26-17-8-4-7-16(13-17)22-21(23(30)15-5-2-1-3-6-15)24(31)25(32)27(22)18-9-11-19(12-10-18)33-14-20(28)29/h1-13,22,31H,14H2,(H,28,29)
InChIKey LKFCGTVCDRNOHS-UHFFFAOYSA-N
Mol Weight 447.42 g/mol
Molecular Formula C25H18FNO6
Exact Mass 447.111815 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2RXhzHZK3q0
Name acetic acid, [4-[3-benzoyl-2-(3-fluorophenyl)-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-1-yl]phenoxy]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 447.111815461 u
Formula C25H18FNO6
InChI InChI=1S/C25H18FNO6/c26-17-8-4-7-16(13-17)22-21(23(30)15-5-2-1-3-6-15)24(31)25(32)27(22)18-9-11-19(12-10-18)33-14-20(28)29/h1-13,22,31H,14H2,(H,28,29)
InChIKey LKFCGTVCDRNOHS-UHFFFAOYSA-N
Molecular Weight 447.418 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17962
Solvent DMSO-d6
Source Vendor ID: NMR/11240403; Lab Info: GEI; Lab Number: GEI-G008062