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pyrido[2,3-d]pyrimidin-4(1H)-one, 1-cyclopentyl-5-(difluoromethyl)-2-mercapto-7-(4-methylphenyl)-
SpectraBase Compound ID 3YgiUku7bN0
InChI InChI=1S/C20H19F2N3OS/c1-11-6-8-12(9-7-11)15-10-14(17(21)22)16-18(23-15)25(13-4-2-3-5-13)20(27)24-19(16)26/h6-10,13,17H,2-5H2,1H3,(H,24,26,27)
InChIKey ZMENLZTUAXZLBX-UHFFFAOYSA-N
Mol Weight 387.45 g/mol
Molecular Formula C20H19F2N3OS
Exact Mass 387.12169 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IIJFKV3UUpC
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 1-cyclopentyl-5-(difluoromethyl)-2-mercapto-7-(4-methylphenyl)-
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/C20H19F2N3OS/c1-11-6-8-12(9-7-11)15-10-14(17(21)22)16-18(23-15)25(13-4-2-3-5-13)20(27)24-19(16)26/h6-10,13,17H,2-5H2,1H3,(H,24,26,27)
InChIKey ZMENLZTUAXZLBX-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23459
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: 2279115; UZI_ID: UZI-023467
Temperature 308 °C