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pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(4-bromophenyl)-1-cyclopropyl-5-(difluoromethyl)-2-mercapto-
SpectraBase Compound ID 8C1KjcoemA1
InChI InChI=1S/C17H12BrF2N3OS/c18-9-3-1-8(2-4-9)12-7-11(14(19)20)13-15(21-12)23(10-5-6-10)17(25)22-16(13)24/h1-4,7,10,14H,5-6H2,(H,22,24,25)
InChIKey LPXJWZFSQWUIAE-UHFFFAOYSA-N
Mol Weight 424.26 g/mol
Molecular Formula C17H12BrF2N3OS
Exact Mass 422.985253 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ddw9XchthTv
Name pyrido[2,3-d]pyrimidin-4(1H)-one, 7-(4-bromophenyl)-1-cyclopropyl-5-(difluoromethyl)-2-mercapto-
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/C17H12BrF2N3OS/c18-9-3-1-8(2-4-9)12-7-11(14(19)20)13-15(21-12)23(10-5-6-10)17(25)22-16(13)24/h1-4,7,10,14H,5-6H2,(H,22,24,25)
InChIKey LPXJWZFSQWUIAE-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_23225
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: 2278109; UZI_ID: UZI-023233
Temperature 308 °C