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ethyl 6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]-2-furyl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
SpectraBase Compound ID 5vs21QCBgke
InChI InChI=1S/C21H18ClFN2O5/c1-3-27-21(26)18-11(2)29-20(25)14(9-24)19(18)17-7-5-13(30-17)10-28-16-6-4-12(23)8-15(16)22/h4-8,19H,3,10,25H2,1-2H3
InChIKey DDWCOSJSSDYWFU-UHFFFAOYSA-N
Mol Weight 432.84 g/mol
Molecular Formula C21H18ClFN2O5
Exact Mass 432.088828 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LKbBWoPjmxq
Name ethyl 6-amino-4-{5-[(2-chloro-4-fluorophenoxy)methyl]-2-furyl}-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/C21H18ClFN2O5/c1-3-27-21(26)18-11(2)29-20(25)14(9-24)19(18)17-7-5-13(30-17)10-28-16-6-4-12(23)8-15(16)22/h4-8,19H,3,10,25H2,1-2H3
InChIKey DDWCOSJSSDYWFU-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3483
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: 9315493; UBI_ID: UBI-003484
Temperature 308 °C