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pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(3-methoxypropyl)-7-phenyl-5-(trifluoromethyl)-
SpectraBase Compound ID AXIQ7MTOeJg
InChI InChI=1S/C18H16F3N3O2S/c1-26-9-5-8-24-15-14(16(25)23-17(24)27)12(18(19,20)21)10-13(22-15)11-6-3-2-4-7-11/h2-4,6-7,10H,5,8-9H2,1H3,(H,23,25,27)
InChIKey YBRNLWDSIILQCA-UHFFFAOYSA-N
Mol Weight 395.4 g/mol
Molecular Formula C18H16F3N3O2S
Exact Mass 395.091532 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9CuqIktTZUi
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 2-mercapto-1-(3-methoxypropyl)-7-phenyl-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/C18H16F3N3O2S/c1-26-9-5-8-24-15-14(16(25)23-17(24)27)12(18(19,20)21)10-13(22-15)11-6-3-2-4-7-11/h2-4,6-7,10H,5,8-9H2,1H3,(H,23,25,27)
InChIKey YBRNLWDSIILQCA-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21854
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: 2160304; UZI_ID: UZI-021862
Temperature 308 °C