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4-(4-Hydroxyphenyl)-2-methyl-1(2H)-phthalazinone, trimethylacetate

View entire compound with spectra: 1 NMR

4-(4-Hydroxyphenyl)-2-methyl-1(2H)-phthalazinone, trimethylacetate
SpectraBase Compound ID AhJVAI5rZXT
InChI InChI=1S/C20H20N2O3/c1-20(2,3)19(24)25-14-11-9-13(10-12-14)17-15-7-5-6-8-16(15)18(23)22(4)21-17/h5-12H,1-4H3
InChIKey TUZPONOTPRYQGL-UHFFFAOYSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HxIblcJ9rax
Name 4-(4-Hydroxyphenyl)-2-methyl-1(2H)-phthalazinone, trimethylacetate
Comments Computed using HOSE algorithm
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Exact Mass 336.147392509 u
Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-20(2,3)19(24)25-14-11-9-13(10-12-14)17-15-7-5-6-8-16(15)18(23)22(4)21-17/h5-12H,1-4H3
InChIKey TUZPONOTPRYQGL-UHFFFAOYSA-N
Molecular Weight 336.391 g/mol
SMILES C1(=NN(C(C=2C1=CC=CC2)=O)C)C1=CC=C(C=C1)OC(C(C)(C)C)=O