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Benzoic acid, 4-[[1-oxo-3-[1-oxo-4-phenyl-2(1H)-phthalazinyl]propyl]amino]-, methyl ester
SpectraBase Compound ID JDru8Wm0NRr
InChI InChI=1S/C25H21N3O4/c1-32-25(31)18-11-13-19(14-12-18)26-22(29)15-16-28-24(30)21-10-6-5-9-20(21)23(27-28)17-7-3-2-4-8-17/h2-14H,15-16H2,1H3,(H,26,29)
InChIKey SQYRCLZZARAUTO-UHFFFAOYSA-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 GuUY7I78Pwu
Name Benzoic acid, 4-[[1-oxo-3-[1-oxo-4-phenyl-2(1H)-phthalazinyl]propyl]amino]-, methyl ester
Alternate Name(s) 4-[[1-oxo-3-(1-oxo-4-phenyl-2-phthalazinyl)propyl]amino]benzoic acid methyl ester Methyl 4-[3-(1-oxo-4-phenylphthalazin-2-yl)propanoylamino]benzoate Methyl 4-[3-(1-oxo-4-phenyl-phthalazin-2-yl)propanoylamino]benzoate Methyl 4-[3-(1-oxidanylidene-4-phenyl-phthalazin-2-yl)propanoylamino]benzoate
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Formula C25H21N3O4
InChI InChI=1S/C25H21N3O4/c1-32-25(31)18-11-13-19(14-12-18)26-22(29)15-16-28-24(30)21-10-6-5-9-20(21)23(27-28)17-7-3-2-4-8-17/h2-14H,15-16H2,1H3,(H,26,29)
InChIKey SQYRCLZZARAUTO-UHFFFAOYSA-N
Molecular Weight 427.460 g/mol
SMILES N(C(CCN1N=C(c2c(cccc2)C1=O)c1ccccc1)=O)c1ccc(C(=O)OC)cc1
SPLASH splash10-00b9-1390000000-b03a2af11e1d2947ea11
Source of Spectrum IY-1-4595-1
Wiley ID 1653934