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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-mercapto-1-(3-methylphenyl)-5-(trifluoromethyl)-

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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-mercapto-1-(3-methylphenyl)-5-(trifluoromethyl)-
SpectraBase Compound ID Cl58L4TPxD6
InChI InChI=1S/C23H16F3N3O3S/c1-12-3-2-4-14(9-12)29-20-19(21(30)28-22(29)33)15(23(24,25)26)11-16(27-20)13-5-6-17-18(10-13)32-8-7-31-17/h2-6,9-11H,7-8H2,1H3,(H,28,30,33)
InChIKey MPIUGORSCMEOAN-UHFFFAOYSA-N
Mol Weight 471.45 g/mol
Molecular Formula C23H16F3N3O3S
Exact Mass 471.086447 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LMc9bMrBZ6x
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-mercapto-1-(3-methylphenyl)-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/C23H16F3N3O3S/c1-12-3-2-4-14(9-12)29-20-19(21(30)28-22(29)33)15(23(24,25)26)11-16(27-20)13-5-6-17-18(10-13)32-8-7-31-17/h2-6,9-11H,7-8H2,1H3,(H,28,30,33)
InChIKey MPIUGORSCMEOAN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23661
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: 2283646; UZI_ID: UZI-023669
Temperature 308 °C