1-[2-[(3-fluorobenzoyl)amino]benzoyl]isonipecotic acid ethyl ester

SpectraBase Compound ID	BeMyIDeWipY
InChI	InChI=1S/C22H23FN2O4/c1-2-29-22(28)15-10-12-25(13-11-15)21(27)18-8-3-4-9-19(18)24-20(26)16-6-5-7-17(23)14-16/h3-9,14-15H,2,10-13H2,1H3,(H,24,26)
InChIKey	ITGINKIFYALECC-UHFFFAOYSA-N Google Search
Mol Weight	398.43 g/mol
Molecular Formula	C22H23FN2O4
Exact Mass	398.164185 g/mol

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SpectraBase Spectrum ID	7V5pcVFllec
Name	4-piperidinecarboxylic acid, 1-[2-[(3-fluorobenzoyl)amino]benzoyl]-,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	398.164185388 u
Formula	C22H23FN2O4
InChI	InChI=1S/C22H23FN2O4/c1-2-29-22(28)15-10-12-25(13-11-15)21(27)18-8-3-4-9-19(18)24-20(26)16-6-5-7-17(23)14-16/h3-9,14-15H,2,10-13H2,1H3,(H,24,26)
InChIKey	ITGINKIFYALECC-UHFFFAOYSA-N
Molecular Weight	398.434 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_12265
Solvent	DMSO-d6
Source	Vendor ID: NMR/10272029; Lab Info: DEC; Lab Number: DEC-S000204