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Benzoic acid, 3,4-methylenedioxy-, (4-formyl-2,6-dimethoxyphenyl) ester
SpectraBase Compound ID C8vF6VldfYy
InChI InChI=1S/C17H14O7/c1-20-14-5-10(8-18)6-15(21-2)16(14)24-17(19)11-3-4-12-13(7-11)23-9-22-12/h3-8H,9H2,1-2H3
InChIKey UGVFOKUJGYKVTL-UHFFFAOYSA-N
Mol Weight 330.29 g/mol
Molecular Formula C17H14O7
Exact Mass 330.073953 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID h06hhN1ceI
Name Benzoic acid, 3,4-methylenedioxy-, (4-formyl-2,6-dimethoxyphenyl) ester
Comments Computed using HOSE algorithm
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Exact Mass 330.073952784 u
Formula C17H14O7
InChI InChI=1S/C17H14O7/c1-20-14-5-10(8-18)6-15(21-2)16(14)24-17(19)11-3-4-12-13(7-11)23-9-22-12/h3-8H,9H2,1-2H3
InChIKey UGVFOKUJGYKVTL-UHFFFAOYSA-N
Molecular Weight 330.292 g/mol
SMILES C1(OC(C2=CC=3OCOC3C=C2)=O)=C(C=C(C=O)C=C1OC)OC