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2-amino-4-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}phenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
SpectraBase Compound ID FY7URUMA7xj
InChI InChI=1S/C25H21F3N2O4/c1-32-20-9-8-14(10-15(20)13-33-17-5-2-4-16(11-17)25(26,27)28)22-18(12-29)24(30)34-21-7-3-6-19(31)23(21)22/h2,4-5,8-11,22H,3,6-7,13,30H2,1H3
InChIKey DOODYHJAUCHUQK-UHFFFAOYSA-N
Mol Weight 470.45 g/mol
Molecular Formula C25H21F3N2O4
Exact Mass 470.145342 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LCUWnZkNAhm
Name 2-amino-4-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}phenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
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/C25H21F3N2O4/c1-32-20-9-8-14(10-15(20)13-33-17-5-2-4-16(11-17)25(26,27)28)22-18(12-29)24(30)34-21-7-3-6-19(31)23(21)22/h2,4-5,8-11,22H,3,6-7,13,30H2,1H3
InChIKey DOODYHJAUCHUQK-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4608
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: 9674846; UBI_ID: UBI-004609
Temperature 308 °C