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N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanamide
SpectraBase Compound ID DExZ3fO9I1D
InChI InChI=1S/C20H17ClFN5O/c1-2-18(28)24-19-25-20-23-16(12-3-7-14(21)8-4-12)11-17(27(20)26-19)13-5-9-15(22)10-6-13/h3-11,17H,2H2,1H3,(H2,23,24,25,26,28)
InChIKey XOSANJAIWKZBHK-UHFFFAOYSA-N
Mol Weight 397.84 g/mol
Molecular Formula C20H17ClFN5O
Exact Mass 397.110566 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2YovNUmJCDY
Name N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]propanamide
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/C20H17ClFN5O/c1-2-18(28)24-19-25-20-23-16(12-3-7-14(21)8-4-12)11-17(27(20)26-19)13-5-9-15(22)10-6-13/h3-11,17H,2H2,1H3,(H2,23,24,25,26,28)
InChIKey XOSANJAIWKZBHK-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3199
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: D09673; Labnumber: RRVCH-1034; SBI_ID: SBI-003201
Temperature 315 °C