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ethyl 6-amino-5-cyano-4-(3-methoxy-4-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-2-methyl-4H-pyran-3-carboxylate
SpectraBase Compound ID ItHRQzuKK5E
InChI InChI=1S/C25H23F3N2O5/c1-4-33-24(31)21-14(2)35-23(30)18(12-29)22(21)16-8-9-19(20(11-16)32-3)34-13-15-6-5-7-17(10-15)25(26,27)28/h5-11,22H,4,13,30H2,1-3H3
InChIKey KLGOKFGWQHXKAR-UHFFFAOYSA-N
Mol Weight 488.46 g/mol
Molecular Formula C25H23F3N2O5
Exact Mass 488.155906 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3hngAN2xjOi
Name ethyl 6-amino-5-cyano-4-(3-methoxy-4-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-2-methyl-4H-pyran-3-carboxylate
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/C25H23F3N2O5/c1-4-33-24(31)21-14(2)35-23(30)18(12-29)22(21)16-8-9-19(20(11-16)32-3)34-13-15-6-5-7-17(10-15)25(26,27)28/h5-11,22H,4,13,30H2,1-3H3
InChIKey KLGOKFGWQHXKAR-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12697
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: UZI/9124489; UBI_ID: UBI-012700
Temperature 308 °C