3-piperidinecarboxylic acid, 1-[6-ethoxy-3-(4-methylbenzoyl)-4-quinolinyl]-, ethyl ester

SpectraBase Compound ID	1PEG83hyiSQ
InChI	InChI=1S/C27H30N2O4/c1-4-32-21-12-13-24-22(15-21)25(29-14-6-7-20(17-29)27(31)33-5-2)23(16-28-24)26(30)19-10-8-18(3)9-11-19/h8-13,15-16,20H,4-7,14,17H2,1-3H3
InChIKey	NMXQZIBWZOKOML-UHFFFAOYSA-N Google Search
Mol Weight	446.55 g/mol
Molecular Formula	C27H30N2O4
Exact Mass	446.220557 g/mol

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SpectraBase Spectrum ID	1sfGPu9lzvm
Name	3-piperidinecarboxylic acid, 1-[6-ethoxy-3-(4-methylbenzoyl)-4-quinolinyl]-, ethyl 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	446.220557450 u
Formula	C27H30N2O4
InChI	InChI=1S/C27H30N2O4/c1-4-32-21-12-13-24-22(15-21)25(29-14-6-7-20(17-29)27(31)33-5-2)23(16-28-24)26(30)19-10-8-18(3)9-11-19/h8-13,15-16,20H,4-7,14,17H2,1-3H3
InChIKey	NMXQZIBWZOKOML-UHFFFAOYSA-N
Molecular Weight	446.547 g/mol
NMR Offset	17.9973
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2021_8080
Solvent	DMSO-d6
Source	Vendor ID: NMR/13309068