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1,2,4-Triazolo[1,5-a]pyrimidin-5(4H)-one, 2-trifluoromethyl-7-methyl-6-phenoxy-
SpectraBase Compound ID 6W4TQMlIWLA
InChI InChI=1S/C13H9F3N4O2/c1-7-9(22-8-5-3-2-4-6-8)10(21)17-12-18-11(13(14,15)16)19-20(7)12/h2-6H,1H3,(H,17,18,19,21)
InChIKey DCSRXVONYBRBCQ-UHFFFAOYSA-N
Mol Weight 310.24 g/mol
Molecular Formula C13H9F3N4O2
Exact Mass 310.06776 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FFKxUk4FZIZ
Name [1,2,4]triazolo[1,5-a]pyrimidin-5(4H)-one, 7-methyl-6-phenoxy-2-(trifluoromethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.067760033 u
Formula C13H9F3N4O2
InChI InChI=1S/C13H9F3N4O2/c1-7-9(22-8-5-3-2-4-6-8)10(21)17-12-18-11(13(14,15)16)19-20(7)12/h2-6H,1H3,(H,17,18,19,21)
InChIKey DCSRXVONYBRBCQ-UHFFFAOYSA-N
Molecular Weight 310.236 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10501
Solvent DMSO-d6
Source Vendor ID: NMR/10241967; Lab Info: L-17; Lab Number: Gashev,L-17
Temperature 23.85 °C