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3-{(E)-[4-(4-Methylphenoxy)phenyl]methylidene}amino-2-propylquinazolin-4(3H)-one
SpectraBase Compound ID 5Jy0AGZorFJ
InChI InChI=1S/C25H23N3O2/c1-3-6-24-27-23-8-5-4-7-22(23)25(29)28(24)26-17-19-11-15-21(16-12-19)30-20-13-9-18(2)10-14-20/h4-5,7-17H,3,6H2,1-2H3/b26-17+
InChIKey VKZGRTHOYXRTRJ-YZSQISJMSA-N
Mol Weight 397.48 g/mol
Molecular Formula C25H23N3O2
Exact Mass 397.179027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6vrbDIZecc
Name 3-{(E)-[4-(4-Methylphenoxy)phenyl]methylidene}amino-2-propylquinazolin-4(3H)-one
Alternate Name(s) 3-[(E)-[4-(4-methylphenoxy)phenyl]methylideneamino]-2-propyl-4-quinazolinone 3-[(E)-[4-(4-methylphenoxy)phenyl]methylideneamino]-2-propylquinazolin-4-one 3-[(E)-[4-(4-methylphenoxy)phenyl]methyleneamino]-2-propyl-quinazolin-4-one 3-[(E)-[4-(4-methylphenoxy)phenyl]methylideneamino]-2-propyl-quinazolin-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C25H23N3O2
InChI InChI=1S/C25H23N3O2/c1-3-6-24-27-23-8-5-4-7-22(23)25(29)28(24)26-17-19-11-15-21(16-12-19)30-20-13-9-18(2)10-14-20/h4-5,7-17H,3,6H2,1-2H3/b26-17+
InChIKey VKZGRTHOYXRTRJ-YZSQISJMSA-N
Molecular Weight 397.478 g/mol
SMILES C1(N(C(=Nc2ccccc12)CCC)\N=C\c1ccc(Oc2ccc(cc2)C)cc1)=O
SPLASH splash10-0002-0009000000-b98e81d9579cad362c47
Source of Spectrum F2-46-1017-3
Wiley ID 1690151