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pyrido[2,3-d]pyrimidin-4(1H)-one, 5-(difluoromethyl)-2-mercapto-1-(2-methoxyphenyl)-7-(3-methoxyphenyl)-
SpectraBase Compound ID LDd2biIMEQ4
InChI InChI=1S/C22H17F2N3O3S/c1-29-13-7-5-6-12(10-13)15-11-14(19(23)24)18-20(25-15)27(22(31)26-21(18)28)16-8-3-4-9-17(16)30-2/h3-11,19H,1-2H3,(H,26,28,31)
InChIKey YEJWRBCJTNCJDX-UHFFFAOYSA-N
Mol Weight 441.45 g/mol
Molecular Formula C22H17F2N3O3S
Exact Mass 441.095869 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HpX2V4elG5q
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 5-(difluoromethyl)-2-mercapto-1-(2-methoxyphenyl)-7-(3-methoxyphenyl)-
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/C22H17F2N3O3S/c1-29-13-7-5-6-12(10-13)15-11-14(19(23)24)18-20(25-15)27(22(31)26-21(18)28)16-8-3-4-9-17(16)30-2/h3-11,19H,1-2H3,(H,26,28,31)
InChIKey YEJWRBCJTNCJDX-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23258
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: 2278259; UZI_ID: UZI-023266
Temperature 308 °C