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(5-ethyl-2-thienyl)[7-(3-phenoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methanone
SpectraBase Compound ID H1RjaPcOOfl
InChI InChI=1S/C25H19F3N4O2S/c1-2-18-11-12-19(35-18)22(33)20-21(32-24(29-14-30-32)31-23(20)25(26,27)28)15-7-6-10-17(13-15)34-16-8-4-3-5-9-16/h3-14,21H,2H2,1H3,(H,29,30,31)
InChIKey PFJXSVYUFOOZSQ-UHFFFAOYSA-N
Mol Weight 496.51 g/mol
Molecular Formula C25H19F3N4O2S
Exact Mass 496.118082 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1ejEiZkO1Ou
Name (5-ethyl-2-thienyl)[7-(3-phenoxyphenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]methanone
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/C25H19F3N4O2S/c1-2-18-11-12-19(35-18)22(33)20-21(32-24(29-14-30-32)31-23(20)25(26,27)28)15-7-6-10-17(13-15)34-16-8-4-3-5-9-16/h3-14,21H,2H2,1H3,(H,29,30,31)
InChIKey PFJXSVYUFOOZSQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_32237
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: 1844780; SBI_ID: SBI-032241
Temperature 318 °C