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4-(4-Fluoro-phenyl)-2-trifluoromethyl-2H-pyrido[1,2-a][1,3,5]triazine-2-carboxylic acid methyl ester
SpectraBase Compound ID CSYqz37r58k
InChI InChI=1S/C16H11F4N3O2/c1-25-14(24)15(16(18,19)20)21-12-4-2-3-9-23(12)13(22-15)10-5-7-11(17)8-6-10/h2-9H,1H3
InChIKey DAMGEMUMNFUHNK-UHFFFAOYSA-N
Mol Weight 353.28 g/mol
Molecular Formula C16H11F4N3O2
Exact Mass 353.078739 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F0wvTgRF8C1
Name 2H-pyrido[1,2-a][1,3,5]triazine-2-carboxylic acid, 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 353.078739256 u
Formula C16H11F4N3O2
InChI InChI=1S/C16H11F4N3O2/c1-25-14(24)15(16(18,19)20)21-12-4-2-3-9-23(12)13(22-15)10-5-7-11(17)8-6-10/h2-9H,1H3
InChIKey DAMGEMUMNFUHNK-UHFFFAOYSA-N
Molecular Weight 353.277 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16707
Solvent DMSO-d6
Source Vendor ID: NMR/10321964; Lab Info: AU; Lab Number: AU-Z000700