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pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-[(tetrahydro-2-furanyl)methyl]-7-(2-thienyl)-5-(trifluoromethyl)-
SpectraBase Compound ID Kxo0MQygskU
InChI InChI=1S/C17H14F3N3O2S2/c18-17(19,20)10-7-11(12-4-2-6-27-12)21-14-13(10)15(24)22-16(26)23(14)8-9-3-1-5-25-9/h2,4,6-7,9H,1,3,5,8H2,(H,22,24,26)
InChIKey BHYCDVPMLOVMQT-UHFFFAOYSA-N
Mol Weight 413.43 g/mol
Molecular Formula C17H14F3N3O2S2
Exact Mass 413.047954 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CgKKFyMNCu7
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-[(tetrahydro-2-furanyl)methyl]-7-(2-thienyl)-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/C17H14F3N3O2S2/c18-17(19,20)10-7-11(12-4-2-6-27-12)21-14-13(10)15(24)22-16(26)23(14)8-9-3-1-5-25-9/h2,4,6-7,9H,1,3,5,8H2,(H,22,24,26)
InChIKey BHYCDVPMLOVMQT-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23327
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: 2278527; UZI_ID: UZI-023335
Temperature 308 °C