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pyrido[2,3-d]pyrimidin-4(1H)-one, 1-butyl-5-(difluoromethyl)-7-(4-fluorophenyl)-2-mercapto-
SpectraBase Compound ID LsX0yZwnLrY
InChI InChI=1S/C18H16F3N3OS/c1-2-3-8-24-16-14(17(25)23-18(24)26)12(15(20)21)9-13(22-16)10-4-6-11(19)7-5-10/h4-7,9,15H,2-3,8H2,1H3,(H,23,25,26)
InChIKey AVLKDHFQCXXCBL-UHFFFAOYSA-N
Mol Weight 379.4 g/mol
Molecular Formula C18H16F3N3OS
Exact Mass 379.096618 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D5WNDRYFVRn
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 1-butyl-5-(difluoromethyl)-7-(4-fluorophenyl)-2-mercapto-
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/C18H16F3N3OS/c1-2-3-8-24-16-14(17(25)23-18(24)26)12(15(20)21)9-13(22-16)10-4-6-11(19)7-5-10/h4-7,9,15H,2-3,8H2,1H3,(H,23,25,26)
InChIKey AVLKDHFQCXXCBL-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_26143
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: 2283884; UZI_ID: UZI-026153
Temperature 308 °C