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3-pyridinecarboxylic acid, 4-(3-chlorophenyl)-1,4,5,6-tetrahydro-2-methyl-6-oxo-, 2-phenylethyl ester
SpectraBase Compound ID 92bu0Fde0zt
InChI InChI=1S/C21H20ClNO3/c1-14-20(21(25)26-11-10-15-6-3-2-4-7-15)18(13-19(24)23-14)16-8-5-9-17(22)12-16/h2-9,12,18H,10-11,13H2,1H3,(H,23,24)
InChIKey ULKUIKKXALTIEE-UHFFFAOYSA-N
Mol Weight 369.85 g/mol
Molecular Formula C21H20ClNO3
Exact Mass 369.113171 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EgYYufyPCwm
Name 3-pyridinecarboxylic acid, 4-(3-chlorophenyl)-1,4,5,6-tetrahydro-2-methyl-6-oxo-, 2-phenylethyl 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 369.113171205 u
Formula C21H20ClNO3
InChI InChI=1S/C21H20ClNO3/c1-14-20(21(25)26-11-10-15-6-3-2-4-7-15)18(13-19(24)23-14)16-8-5-9-17(22)12-16/h2-9,12,18H,10-11,13H2,1H3,(H,23,24)
InChIKey ULKUIKKXALTIEE-UHFFFAOYSA-N
Molecular Weight 369.848 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8094
Solvent DMSO-d6
Source Vendor ID: NMR/9291203; Lab Info: SAS; Lab Number: SAS-tst2942
Temperature 29.85 °C