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2-Pyrroline-3-carboxylic acid, 1-(4-fluorophenyl)-2-methyl-5-oxo-, methyl ester

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2-Pyrroline-3-carboxylic acid, 1-(4-fluorophenyl)-2-methyl-5-oxo-, methyl ester
SpectraBase Compound ID A9SIMm7Nye8
InChI InChI=1S/C13H12FNO3/c1-8-11(13(17)18-2)7-12(16)15(8)10-5-3-9(14)4-6-10/h3-6H,7H2,1-2H3
InChIKey SMCOTCXZDZNNSH-UHFFFAOYSA-N
Mol Weight 249.24 g/mol
Molecular Formula C13H12FNO3
Exact Mass 249.080121 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A9wSK0u78TH
Name 1H-pyrrole-3-carboxylic acid, 1-(4-fluorophenyl)-4,5-dihydro-2-methyl-5-oxo-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 249.080121410 u
Formula C13H12FNO3
InChI InChI=1S/C13H12FNO3/c1-8-11(13(17)18-2)7-12(16)15(8)10-5-3-9(14)4-6-10/h3-6H,7H2,1-2H3
InChIKey SMCOTCXZDZNNSH-UHFFFAOYSA-N
Molecular Weight 249.241 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9837
Solvent DMSO-d6
Source Vendor ID: NMR/9313557; Lab Info: LD; Lab Number: LD-8014474