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7-Bromo-4-(4-fluorophenyl)-2-(trifluoromethyl)-2-pyrido[1,2-a][1,3,5]triazinecarboxylic acid methyl ester
SpectraBase Compound ID 80AcxMpnuiE
InChI InChI=1S/C16H10BrF4N3O2/c1-26-14(25)15(16(19,20)21)22-12-7-4-10(17)8-24(12)13(23-15)9-2-5-11(18)6-3-9/h2-8H,1H3
InChIKey PBIRLXWFIBNXAA-UHFFFAOYSA-N
Mol Weight 432.17 g/mol
Molecular Formula C16H10BrF4N3O2
Exact Mass 430.989252 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4dXrt56Iel3
Name 2H-pyrido[1,2-a][1,3,5]triazine-2-carboxylic acid, 7-bromo-4-(4-fluorophenyl)-2-(trifluoromethyl)-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.989252224 u
Formula C16H10BrF4N3O2
InChI InChI=1S/C16H10BrF4N3O2/c1-26-14(25)15(16(19,20)21)22-12-7-4-10(17)8-24(12)13(23-15)9-2-5-11(18)6-3-9/h2-8H,1H3
InChIKey PBIRLXWFIBNXAA-UHFFFAOYSA-N
Molecular Weight 432.173 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15117
Solvent DMSO-d6
Source Vendor ID: NMR/10321966; Lab Info: AU; Lab Number: AU-Z000703