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ethyl 6-amino-4-{3-[(2-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
SpectraBase Compound ID LHC6Wukd82A
InChI InChI=1S/C24H22ClFN2O5/c1-4-31-24(29)21-13(2)33-23(28)17(11-27)22(21)14-5-7-19(30-3)15(9-14)12-32-20-8-6-16(26)10-18(20)25/h5-10,22H,4,12,28H2,1-3H3
InChIKey NIPOCVAHLOVQOP-UHFFFAOYSA-N
Mol Weight 472.9 g/mol
Molecular Formula C24H22ClFN2O5
Exact Mass 472.120128 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LEXi5IyDQzZ
Name ethyl 6-amino-4-{3-[(2-chloro-4-fluorophenoxy)methyl]-4-methoxyphenyl}-5-cyano-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/C24H22ClFN2O5/c1-4-31-24(29)21-13(2)33-23(28)17(11-27)22(21)14-5-7-19(30-3)15(9-14)12-32-20-8-6-16(26)10-18(20)25/h5-10,22H,4,12,28H2,1-3H3
InChIKey NIPOCVAHLOVQOP-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4615
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: 9683504; UBI_ID: UBI-004616
Temperature 308 °C