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2,4-Bis(4-methylbenzoyl)-5,6-dihydrobenzo[h]quinazoline

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2,4-Bis(4-methylbenzoyl)-5,6-dihydrobenzo[h]quinazoline
SpectraBase Compound ID 8pkKbbSzKqn
InChI InChI=1S/C28H22N2O2/c1-17-7-11-20(12-8-17)26(31)25-23-16-15-19-5-3-4-6-22(19)24(23)29-28(30-25)27(32)21-13-9-18(2)10-14-21/h3-14H,15-16H2,1-2H3
InChIKey UUSCGKPMDOAMJX-UHFFFAOYSA-N
Mol Weight 418.5 g/mol
Molecular Formula C28H22N2O2
Exact Mass 418.168128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8dPWv0JQjCC
Name 2,4-bis(4-Methylbenzoyl)-5,6-dihydrobenzo[H]quinazoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.168127954 u
Formula C28H22N2O2
InChI InChI=1S/C28H22N2O2/c1-17-7-11-20(12-8-17)26(31)25-23-16-15-19-5-3-4-6-22(19)24(23)29-28(30-25)27(32)21-13-9-18(2)10-14-21/h3-14H,15-16H2,1-2H3
InChIKey UUSCGKPMDOAMJX-UHFFFAOYSA-N
Molecular Weight 418.496 g/mol
SMILES C=1(N=C2C=3C(CCC2=C(N1)C(C=1C=CC(=CC1)C)=O)=CC=CC3)C(C=1C=CC(=CC1)C)=O