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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-[4-(difluoromethoxy)-3-methoxyphenyl]-2-mercapto-1-methyl-5-(trifluoromethyl)-
SpectraBase Compound ID 7F566v9k8cz
InChI InChI=1S/C17H12F5N3O3S/c1-25-13-12(14(26)24-16(25)29)8(17(20,21)22)6-9(23-13)7-3-4-10(28-15(18)19)11(5-7)27-2/h3-6,15H,1-2H3,(H,24,26,29)
InChIKey JXKBEOLBLAUPFR-UHFFFAOYSA-N
Mol Weight 433.35 g/mol
Molecular Formula C17H12F5N3O3S
Exact Mass 433.051953 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CVgsIxtnbBy
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-[4-(difluoromethoxy)-3-methoxyphenyl]-2-mercapto-1-methyl-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/C17H12F5N3O3S/c1-25-13-12(14(26)24-16(25)29)8(17(20,21)22)6-9(23-13)7-3-4-10(28-15(18)19)11(5-7)27-2/h3-6,15H,1-2H3,(H,24,26,29)
InChIKey JXKBEOLBLAUPFR-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21815
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: 2143955; UZI_ID: UZI-021823
Temperature 308 °C