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2-Formyl-4,5-methylenedioxyphenylacetic Acid
SpectraBase Compound ID 8L8fGFwcYsX
InChI InChI=1S/C10H8O5/c11-4-7-2-9-8(14-5-15-9)1-6(7)3-10(12)13/h1-2,4H,3,5H2,(H,12,13)
InChIKey JNTYCNPJIKBIFA-UHFFFAOYSA-N
Mol Weight 208.17 g/mol
Molecular Formula C10H8O5
Exact Mass 208.037173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kt2xXba4J8P
Name 2-Formyl-4,5-methylenedioxyphenylacetic Acid
Alternate Name(s) (6-formyl-1,3-benzodioxol-5-yl)acetic acid 2-(6-Methanoyl-1,3-benzodioxol-5-yl)ethanoic acid
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Formula C10H8O5
InChI InChI=1S/C10H8O5/c11-4-7-2-9-8(14-5-15-9)1-6(7)3-10(12)13/h1-2,4H,3,5H2,(H,12,13)
InChIKey JNTYCNPJIKBIFA-UHFFFAOYSA-N
Molecular Weight 208.169 g/mol
SMILES OC(Cc1c(cc2c(c1)OCO2)C=O)=O
SPLASH splash10-03di-3910000000-ef36b46fa80218619b2f
Source of Spectrum KC-1991-173-17
Wiley ID 1206371