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3-Phenylpropyl 4-(2-chloro-6-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate

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3-Phenylpropyl 4-(2-chloro-6-fluorophenyl)-2-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridinecarboxylate
SpectraBase Compound ID QupVtYWaMk
InChI InChI=1S/C22H21ClFNO3/c1-14-20(22(27)28-12-6-9-15-7-3-2-4-8-15)16(13-19(26)25-14)21-17(23)10-5-11-18(21)24/h2-5,7-8,10-11,16H,6,9,12-13H2,1H3,(H,25,26)
InChIKey JNTLLDXNFSOUMU-UHFFFAOYSA-N
Mol Weight 401.87 g/mol
Molecular Formula C22H21ClFNO3
Exact Mass 401.119399 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gf7md3ZEiZ3
Name 3-pyridinecarboxylic acid, 4-(2-chloro-6-fluorophenyl)-1,4,5,6-tetrahydro-2-methyl-6-oxo-, 3-phenylpropyl ester
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 401.119399400 u
Formula C22H21ClFNO3
InChI InChI=1S/C22H21ClFNO3/c1-14-20(22(27)28-12-6-9-15-7-3-2-4-8-15)16(13-19(26)25-14)21-17(23)10-5-11-18(21)24/h2-5,7-8,10-11,16H,6,9,12-13H2,1H3,(H,25,26)
InChIKey JNTLLDXNFSOUMU-UHFFFAOYSA-N
Molecular Weight 401.865 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8092
Solvent DMSO-d6
Source Vendor ID: NMR/9291198; Lab Info: SAS; Lab Number: SAS-tst2936
Temperature 29.85 °C