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3-({(E)-[4-(1,3-benzodioxol-5-yloxy)phenyl]methylidene}amino)-2-propylquinazolin-4(3H)-one
SpectraBase Compound ID DFUm9uianAx
InChI InChI=1S/C25H21N3O4/c1-2-5-24-27-21-7-4-3-6-20(21)25(29)28(24)26-15-17-8-10-18(11-9-17)32-19-12-13-22-23(14-19)31-16-30-22/h3-4,6-15H,2,5,16H2,1H3/b26-15+
InChIKey PDBZCEPFZMIFBK-CVKSISIWSA-N
Mol Weight 427.46 g/mol
Molecular Formula C25H21N3O4
Exact Mass 427.153206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E5ioHVX6yDn
Name 3-({(E)-[4-(1,3-Benzodioxol-5-yloxy)phenyl]methylidene}amino)-2-propylquinazolin-4(3H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C25H21N3O4
InChI InChI=1S/C25H21N3O4/c1-2-5-24-27-21-7-4-3-6-20(21)25(29)28(24)26-15-17-8-10-18(11-9-17)32-19-12-13-22-23(14-19)31-16-30-22/h3-4,6-15H,2,5,16H2,1H3/b26-15+
InChIKey PDBZCEPFZMIFBK-CVKSISIWSA-N
Molecular Weight 427.460 g/mol
SMILES C1(N(C(=Nc2ccccc12)CCC)\N=C\c1ccc(Oc2cc3c(OCO3)cc2)cc1)=O
SPLASH splash10-004i-0000900000-5c187a42c5805002fe59
Source of Spectrum F2-46-1017-9
Synonyms 3-[(E)-[4-(1,3-benzodioxol-5-yloxy)phenyl]methylideneamino]-2-propyl-4-quinazolinone 3-[(E)-[4-(1,3-benzodioxol-5-yloxy)phenyl]methylideneamino]-2-propylquinazolin-4-one 3-[(E)-[4-(1,3-benzodioxol-5-yloxy)phenyl]methyleneamino]-2-propyl-quinazolin-4-one 3-[(E)-[4-(1,3-benzodioxol-5-yloxy)phenyl]methylideneamino]-2-propyl-quinazolin-4-one
Wiley ID 1690145