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di[1,2,4]triazolo[4,3-a:1,5-c]quinazoline-3-butanamide, N-[(4-fluorophenyl)methyl]-10-phenyl-
SpectraBase Compound ID IdrAxrRVE52
InChI InChI=1S/C27H22FN7O/c28-20-15-13-18(14-16-20)17-29-24(36)12-6-11-23-31-32-27-34(23)22-10-5-4-9-21(22)26-30-25(33-35(26)27)19-7-2-1-3-8-19/h1-5,7-10,13-16H,6,11-12,17H2,(H,29,36)
InChIKey DEFMHCCBDKOQLB-UHFFFAOYSA-N
Mol Weight 479.52 g/mol
Molecular Formula C27H22FN7O
Exact Mass 479.186987 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Iwr2V9hiGQQ
Name di[1,2,4]triazolo[4,3-a:1,5-c]quinazoline-3-butanamide, N-[(4-fluorophenyl)methyl]-10-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 479.186986518 u
Formula C27H22FN7O
InChI InChI=1S/C27H22FN7O/c28-20-15-13-18(14-16-20)17-29-24(36)12-6-11-23-31-32-27-34(23)22-10-5-4-9-21(22)26-30-25(33-35(26)27)19-7-2-1-3-8-19/h1-5,7-10,13-16H,6,11-12,17H2,(H,29,36)
InChIKey DEFMHCCBDKOQLB-UHFFFAOYSA-N
Molecular Weight 479.519 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4587
Solvent DMSO-d6
Source Vendor ID: NMR/13288226