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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(5-chloro-2-thienyl)-2-mercapto-1-[(tetrahydro-2-furanyl)methyl]-5-(trifluoromethyl)-

View entire compound with spectra: 1 NMR

pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(5-chloro-2-thienyl)-2-mercapto-1-[(tetrahydro-2-furanyl)methyl]-5-(trifluoromethyl)-
SpectraBase Compound ID EcgH0EcDuvn
InChI InChI=1S/C17H13ClF3N3O2S2/c18-12-4-3-11(28-12)10-6-9(17(19,20)21)13-14(22-10)24(16(27)23-15(13)25)7-8-2-1-5-26-8/h3-4,6,8H,1-2,5,7H2,(H,23,25,27)
InChIKey FSMMPQIJTSNEFI-UHFFFAOYSA-N
Mol Weight 447.88 g/mol
Molecular Formula C17H13ClF3N3O2S2
Exact Mass 447.008981 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IlqJAUViyxZ
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(5-chloro-2-thienyl)-2-mercapto-1-[(tetrahydro-2-furanyl)methyl]-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/C17H13ClF3N3O2S2/c18-12-4-3-11(28-12)10-6-9(17(19,20)21)13-14(22-10)24(16(27)23-15(13)25)7-8-2-1-5-26-8/h3-4,6,8H,1-2,5,7H2,(H,23,25,27)
InChIKey FSMMPQIJTSNEFI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23382
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: 2278756; UZI_ID: UZI-023390
Temperature 308 °C