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2-amino-4-{3-[(2-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
SpectraBase Compound ID 5zrKH9bWs4A
InChI InChI=1S/C24H20ClFN2O4/c1-30-19-7-5-13(9-14(19)12-31-20-8-6-15(26)10-17(20)25)22-16(11-27)24(28)32-21-4-2-3-18(29)23(21)22/h5-10,22H,2-4,12,28H2,1H3
InChIKey IZTCXFGHNSXREM-UHFFFAOYSA-N
Mol Weight 454.89 g/mol
Molecular Formula C24H20ClFN2O4
Exact Mass 454.109563 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2KOhGjLRPYh
Name 2-amino-4-{3-[(2-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-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/C24H20ClFN2O4/c1-30-19-7-5-13(9-14(19)12-31-20-8-6-15(26)10-17(20)25)22-16(11-27)24(28)32-21-4-2-3-18(29)23(21)22/h5-10,22H,2-4,12,28H2,1H3
InChIKey IZTCXFGHNSXREM-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4613
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: 9680237; UBI_ID: UBI-004614
Temperature 308 °C