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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(4-bromophenyl)-2-mercapto-1-methyl-5-(trifluoromethyl)-
SpectraBase Compound ID aWAvn4MC9Y
InChI InChI=1S/C15H9BrF3N3OS/c1-22-12-11(13(23)21-14(22)24)9(15(17,18)19)6-10(20-12)7-2-4-8(16)5-3-7/h2-6H,1H3,(H,21,23,24)
InChIKey XAALFJBPHWTPGX-UHFFFAOYSA-N
Mol Weight 416.22 g/mol
Molecular Formula C15H9BrF3N3OS
Exact Mass 414.960181 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3jKiAnSDa1f
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(4-bromophenyl)-2-mercapto-1-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/C15H9BrF3N3OS/c1-22-12-11(13(23)21-14(22)24)9(15(17,18)19)6-10(20-12)7-2-4-8(16)5-3-7/h2-6H,1H3,(H,21,23,24)
InChIKey XAALFJBPHWTPGX-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21867
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: 2167501; UZI_ID: UZI-021875
Temperature 308 °C