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di[1,2,4]triazolo[4,3-a:1,5-c]quinazoline-3-butanamide, N-[(2-chlorophenyl)methyl]-10-phenyl-
SpectraBase Compound ID 1GkOcX89K2x
InChI InChI=1S/C27H22ClN7O/c28-21-13-6-4-11-19(21)17-29-24(36)16-8-15-23-31-32-27-34(23)22-14-7-5-12-20(22)26-30-25(33-35(26)27)18-9-2-1-3-10-18/h1-7,9-14H,8,15-17H2,(H,29,36)
InChIKey VINRAHRWBJLFKQ-UHFFFAOYSA-N
Mol Weight 495.97 g/mol
Molecular Formula C27H22ClN7O
Exact Mass 495.157436 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Kx5fcSkIJSv
Name di[1,2,4]triazolo[4,3-a:1,5-c]quinazoline-3-butanamide, N-[(2-chlorophenyl)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 495.157436055 u
Formula C27H22ClN7O
InChI InChI=1S/C27H22ClN7O/c28-21-13-6-4-11-19(21)17-29-24(36)16-8-15-23-31-32-27-34(23)22-14-7-5-12-20(22)26-30-25(33-35(26)27)18-9-2-1-3-10-18/h1-7,9-14H,8,15-17H2,(H,29,36)
InChIKey VINRAHRWBJLFKQ-UHFFFAOYSA-N
Molecular Weight 495.974 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_4590
Solvent DMSO-d6
Source Vendor ID: NMR/13288229