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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-[4-(difluoromethoxy)phenyl]-1-(2-ethoxyphenyl)-2-mercapto-5-(trifluoromethyl)-
SpectraBase Compound ID 5JXnvCCaA8k
InChI InChI=1S/C23H16F5N3O3S/c1-2-33-17-6-4-3-5-16(17)31-19-18(20(32)30-22(31)35)14(23(26,27)28)11-15(29-19)12-7-9-13(10-8-12)34-21(24)25/h3-11,21H,2H2,1H3,(H,30,32,35)
InChIKey FSKNSWZONWAPGJ-UHFFFAOYSA-N
Mol Weight 509.45 g/mol
Molecular Formula C23H16F5N3O3S
Exact Mass 509.083253 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KzdEIv4cGm5
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-[4-(difluoromethoxy)phenyl]-1-(2-ethoxyphenyl)-2-mercapto-5-(trifluoromethyl)-
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/C23H16F5N3O3S/c1-2-33-17-6-4-3-5-16(17)31-19-18(20(32)30-22(31)35)14(23(26,27)28)11-15(29-19)12-7-9-13(10-8-12)34-21(24)25/h3-11,21H,2H2,1H3,(H,30,32,35)
InChIKey FSKNSWZONWAPGJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23278
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: 2278327; UZI_ID: UZI-023286
Temperature 308 °C