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5-(1,3-benzodioxol-5-yl)benzo[f][1,3]benzodioxole-6,7-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 1uRAYLEVjr3
InChI InChI=1S/C22H16O8/c1-25-21(23)14-5-12-7-17-18(30-10-29-17)8-13(12)19(20(14)22(24)26-2)11-3-4-15-16(6-11)28-9-27-15/h3-8H,9-10H2,1-2H3
InChIKey DJKIGIIWURRXHP-UHFFFAOYSA-N
Mol Weight 408.36 g/mol
Molecular Formula C22H16O8
Exact Mass 408.084517 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oGs6pGuuW
Name 5-(1,3-benzodioxol-5-yl)benzo[f][1,3]benzodioxole-6,7-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 5-(1,3-benzodioxol-5-yl)benzo[f][1,3]benzodioxole-6,7-dicarboxylate
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Formula C22H16O8
InChI InChI=1S/C22H16O8/c1-25-21(23)14-5-12-7-17-18(30-10-29-17)8-13(12)19(20(14)22(24)26-2)11-3-4-15-16(6-11)28-9-27-15/h3-8H,9-10H2,1-2H3
InChIKey DJKIGIIWURRXHP-UHFFFAOYSA-N
Molecular Weight 408.362 g/mol
SMILES c1c(c(c(c2cc3c(cc12)OCO3)-c1cc2c(cc1)OCO2)C(=O)OC)C(=O)OC
SPLASH splash10-0a4i-0319400000-3a959725a1210aa10791
Source of Spectrum KC-57-7762-17
Wiley ID 1625684