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2-amino-4-{4-methoxy-3-[(2,3,4,5,6-pentafluorophenoxy)methyl]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
SpectraBase Compound ID 880cJ49ePdY
InChI InChI=1S/C24H17F5N2O4/c1-33-14-6-5-10(16-12(8-30)24(31)35-15-4-2-3-13(32)17(15)16)7-11(14)9-34-23-21(28)19(26)18(25)20(27)22(23)29/h5-7,16H,2-4,9,31H2,1H3
InChIKey QFHMBGFOSGPHHF-UHFFFAOYSA-N
Mol Weight 492.4 g/mol
Molecular Formula C24H17F5N2O4
Exact Mass 492.110848 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JW2usTdCblq
Name 2-amino-4-{4-methoxy-3-[(2,3,4,5,6-pentafluorophenoxy)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/C24H17F5N2O4/c1-33-14-6-5-10(16-12(8-30)24(31)35-15-4-2-3-13(32)17(15)16)7-11(14)9-34-23-21(28)19(26)18(25)20(27)22(23)29/h5-7,16H,2-4,9,31H2,1H3
InChIKey QFHMBGFOSGPHHF-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12752
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/9125188; UBI_ID: UBI-012755
Temperature 318 °C