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3-benzyl-2-{(E)-2-[4-(dimethylamino)phenyl]ethenyl}-4(3H)-quinazolinone
SpectraBase Compound ID H6QIMa7CfGJ
InChI InChI=1S/C25H23N3O/c1-27(2)21-15-12-19(13-16-21)14-17-24-26-23-11-7-6-10-22(23)25(29)28(24)18-20-8-4-3-5-9-20/h3-17H,18H2,1-2H3/b17-14+
InChIKey BDHSTNWDSOIJGT-SAPNQHFASA-N
Mol Weight 381.48 g/mol
Molecular Formula C25H23N3O
Exact Mass 381.184112 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HNLPtLgtV4r
Name 3-Benzyl-2-{(E)-2-[4-(dimethylamino)phenyl]ethenyl}-4(3H)-quinazolinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 381.184112372 u
Formula C25H23N3O
InChI InChI=1S/C25H23N3O/c1-27(2)21-15-12-19(13-16-21)14-17-24-26-23-11-7-6-10-22(23)25(29)28(24)18-20-8-4-3-5-9-20/h3-17H,18H2,1-2H3/b17-14+
InChIKey BDHSTNWDSOIJGT-SAPNQHFASA-N
Molecular Weight 381.479 g/mol
SMILES C1=CC=C(CN2C(C=3C=CC=CC3N=C2\C=C\C2=CC=C(C=C2)N(C)C)=O)C=C1