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2-(4-chlorophenyl)-7-(4-fluorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
SpectraBase Compound ID Kb5dkNRgvLI
InChI InChI=1S/C23H16ClFN4/c24-18-10-6-17(7-11-18)22-27-23-26-20(15-4-2-1-3-5-15)14-21(29(23)28-22)16-8-12-19(25)13-9-16/h1-14,21H,(H,26,27,28)
InChIKey PSDBGOMFXKCACQ-UHFFFAOYSA-N
Mol Weight 402.86 g/mol
Molecular Formula C23H16ClFN4
Exact Mass 402.104752 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AMnJtpABX5J
Name 2-(4-chlorophenyl)-7-(4-fluorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
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/C23H16ClFN4/c24-18-10-6-17(7-11-18)22-27-23-26-20(15-4-2-1-3-5-15)14-21(29(23)28-22)16-8-12-19(25)13-9-16/h1-14,21H,(H,26,27,28)
InChIKey PSDBGOMFXKCACQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_926
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: C94799; Labnumber: RRVCH-0443; SBI_ID: SBI-000928
Temperature 318 °C