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7-Bromo-4-p-tolyl-2-trifluoromethyl-2H-pyrido[1,2-a][1,3,5]triazine-2-carboxylic acid methyl ester
SpectraBase Compound ID FHDgtZWJUxJ
InChI InChI=1S/C17H13BrF3N3O2/c1-10-3-5-11(6-4-10)14-23-16(15(25)26-2,17(19,20)21)22-13-8-7-12(18)9-24(13)14/h3-9H,1-2H3
InChIKey WMPXXMMZAPRUOR-UHFFFAOYSA-N
Mol Weight 428.21 g/mol
Molecular Formula C17H13BrF3N3O2
Exact Mass 427.014324 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GzGeTuwyacQ
Name 2H-pyrido[1,2-a][1,3,5]triazine-2-carboxylic acid, 7-bromo-4-(4-methylphenyl)-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 427.014324158 u
Formula C17H13BrF3N3O2
InChI InChI=1S/C17H13BrF3N3O2/c1-10-3-5-11(6-4-10)14-23-16(15(25)26-2,17(19,20)21)22-13-8-7-12(18)9-24(13)14/h3-9H,1-2H3
InChIKey WMPXXMMZAPRUOR-UHFFFAOYSA-N
Molecular Weight 428.209 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13057
Solvent DMSO-d6
Source Vendor ID: NMR/10301027; Lab Info: AU; Lab Number: AU-Z000440