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4(3H)-quinazolinone, 2-[(E)-2-(1,2-dimethyl-1H-indol-3-yl)ethenyl]-3-(4-methylphenyl)-
SpectraBase Compound ID DHd4ABS66fC
InChI InChI=1S/C27H23N3O/c1-18-12-14-20(15-13-18)30-26(28-24-10-6-4-9-23(24)27(30)31)17-16-21-19(2)29(3)25-11-7-5-8-22(21)25/h4-17H,1-3H3/b17-16+
InChIKey CBUZKAZCNXKPJB-WUKNDPDISA-N
Mol Weight 405.5 g/mol
Molecular Formula C27H23N3O
Exact Mass 405.184112 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FbYC6E3165Z
Name 4(3H)-Quinazolinone, 2-[(E)-2-(1,2-dimethyl-1H-indol-3-yl)ethenyl]-3-(4-methylphenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 405.184112372 u
Formula C27H23N3O
InChI InChI=1S/C27H23N3O/c1-18-12-14-20(15-13-18)30-26(28-24-10-6-4-9-23(24)27(30)31)17-16-21-19(2)29(3)25-11-7-5-8-22(21)25/h4-17H,1-3H3/b17-16+
InChIKey CBUZKAZCNXKPJB-WUKNDPDISA-N
Molecular Weight 405.501 g/mol
SMILES C1=CC=2N=C(N(C(C2C=C1)=O)C=1C=CC(=CC1)C)\C=C\C1=C(N(C)C2=C1C=CC=C2)C