4H-pyran-3-carboxylic acid, 6-amino-5-cyano-2-phenyl-4-[2-(trifluoromethyl)phenyl]-, ethyl ester

SpectraBase Compound ID	DIBJt1CQxS5
InChI	InChI=1S/C22H17F3N2O3/c1-2-29-21(28)18-17(14-10-6-7-11-16(14)22(23,24)25)15(12-26)20(27)30-19(18)13-8-4-3-5-9-13/h3-11,17H,2,27H2,1H3
InChIKey	HBJVZJRHINAZOJ-UHFFFAOYSA-N Google Search
Mol Weight	414.38 g/mol
Molecular Formula	C22H17F3N2O3
Exact Mass	414.119127 g/mol

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SpectraBase Spectrum ID	3sr2jhJcJmj
Name	4H-pyran-3-carboxylic acid, 6-amino-5-cyano-2-phenyl-4-[2-(trifluoromethyl)phenyl]-, ethyl ester
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C22H17F3N2O3/c1-2-29-21(28)18-17(14-10-6-7-11-16(14)22(23,24)25)15(12-26)20(27)30-19(18)13-8-4-3-5-9-13/h3-11,17H,2,27H2,1H3
InChIKey	HBJVZJRHINAZOJ-UHFFFAOYSA-N
NMR Offset	16.0087
NMR Spectrometer Frequency	500.133
Observed nucleus	1H
Origin	1H_ASIOH_8516_1113
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: 63TSH0.303; IOH_ID: IOH-008115