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[1,2,4]triazolo[4,3-a]quinazoline-1-propanamide, 4,5-dihydro-4-[(4-methylphenyl)methyl]-5-oxo-N-(phenylmethyl)-
SpectraBase Compound ID 9fncH41B3D3
InChI InChI=1S/C27H25N5O2/c1-19-11-13-21(14-12-19)18-31-26(34)22-9-5-6-10-23(22)32-24(29-30-27(31)32)15-16-25(33)28-17-20-7-3-2-4-8-20/h2-14H,15-18H2,1H3,(H,28,33)
InChIKey BWHFAFSLZJPYDA-UHFFFAOYSA-N
Mol Weight 451.53 g/mol
Molecular Formula C27H25N5O2
Exact Mass 451.200825 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5UhOmPh4yvw
Name [1,2,4]triazolo[4,3-a]quinazoline-1-propanamide, 4,5-dihydro-4-[(4-methylphenyl)methyl]-5-oxo-N-(phenylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 451.200825063 u
Formula C27H25N5O2
InChI InChI=1S/C27H25N5O2/c1-19-11-13-21(14-12-19)18-31-26(34)22-9-5-6-10-23(22)32-24(29-30-27(31)32)15-16-25(33)28-17-20-7-3-2-4-8-20/h2-14H,15-18H2,1H3,(H,28,33)
InChIKey BWHFAFSLZJPYDA-UHFFFAOYSA-N
Molecular Weight 451.530 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7068
Solvent DMSO-d6
Source Vendor ID: NMR/13289860