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3-(3-{3-[(acetyloxy)methyl]-2-methylphenyl}-1,4-dioxo-1,4-dihydro-2-phthalazinyl)-2-methylbenzyl acetate
SpectraBase Compound ID 3QNLjN5mqie
InChI InChI=1S/C28H26N2O6/c1-17-21(15-35-19(3)31)9-7-13-25(17)29-27(33)23-11-5-6-12-24(23)28(34)30(29)26-14-8-10-22(18(26)2)16-36-20(4)32/h5-14H,15-16H2,1-4H3
InChIKey DMDGDSBCIZHHOV-UHFFFAOYSA-N
Mol Weight 486.52 g/mol
Molecular Formula C28H26N2O6
Exact Mass 486.179087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GfTE7pj8oLQ
Name 3-(3-{3-[(acetyloxy)methyl]-2-methylphenyl}-1,4-dioxo-1,4-dihydro-2-phthalazinyl)-2-methylbenzyl acetate
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Formula C28H26N2O6
InChI InChI=1S/C28H26N2O6/c1-17-21(15-35-19(3)31)9-7-13-25(17)29-27(33)23-11-5-6-12-24(23)28(34)30(29)26-14-8-10-22(18(26)2)16-36-20(4)32/h5-14H,15-16H2,1-4H3
InChIKey DMDGDSBCIZHHOV-UHFFFAOYSA-N
Molecular Weight 486.524 g/mol
SMILES c1ccc2c(c1)C(N(N(C2=O)c1c(c(ccc1)COC(=O)C)C)c1cccc(c1C)COC(=O)C)=O
SPLASH splash10-0f6x-9200000000-a7285a56f6734a8c7bfe
Synonyms 3-(3-{4-[(acetyloxy)methyl]-3-methylphenyl}-1,4-dioxo-1,2,3,4-tetrahydro-2-phthalazinyl)-2-methylbenzyl acetate
Wiley ID 1476444