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3-(4-(4-methylphenyl)-1-oxo-2(1H)-phthalazinyl)-N-(1-naphthyl)propanamide

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3-(4-(4-methylphenyl)-1-oxo-2(1H)-phthalazinyl)-N-(1-naphthyl)propanamide
SpectraBase Compound ID 9btjCjBtcrt
InChI InChI=1S/C28H23N3O2/c1-19-13-15-21(16-14-19)27-23-10-4-5-11-24(23)28(33)31(30-27)18-17-26(32)29-25-12-6-8-20-7-2-3-9-22(20)25/h2-16H,17-18H2,1H3,(H,29,32)
InChIKey UQCIHCFCLDYQFB-UHFFFAOYSA-N
Mol Weight 433.51 g/mol
Molecular Formula C28H23N3O2
Exact Mass 433.179027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59vNx5xf3pf
Name 3-(4-(4-Methylphenyl)-1-oxo-2(1H)-phthalazinyl)-N-(1-naphthyl)propanamide
Comments Computed using HOSE algorithm
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Exact Mass 433.179026991 u
Formula C28H23N3O2
InChI InChI=1S/C28H23N3O2/c1-19-13-15-21(16-14-19)27-23-10-4-5-11-24(23)28(33)31(30-27)18-17-26(32)29-25-12-6-8-20-7-2-3-9-22(20)25/h2-16H,17-18H2,1H3,(H,29,32)
InChIKey UQCIHCFCLDYQFB-UHFFFAOYSA-N
Molecular Weight 433.511 g/mol
SMILES N(C(CCN1N=C(C=2C(=CC=CC2)C1=O)C=1C=CC(=CC1)C)=O)C1=C2C(C=CC=C2)=CC=C1