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Phthalic acid, ethyl furfuryl ester
SpectraBase Compound ID 8yErggMChs7
InChI InChI=1S/C15H18O5/c1-2-18-14(16)12-7-3-4-8-13(12)15(17)20-10-11-6-5-9-19-11/h3-4,7-8,11H,2,5-6,9-10H2,1H3
InChIKey PNLDOVLBWGLSBC-UHFFFAOYSA-N
Mol Weight 278.3 g/mol
Molecular Formula C15H18O5
Exact Mass 278.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BsjwxHZF5FE
Name Phthalic acid, ethyl furfuryl ester
Comments Computed using HOSE algorithm
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Exact Mass 278.115423675 u
Formula C15H18O5
InChI InChI=1S/C15H18O5/c1-2-18-14(16)12-7-3-4-8-13(12)15(17)20-10-11-6-5-9-19-11/h3-4,7-8,11H,2,5-6,9-10H2,1H3
InChIKey PNLDOVLBWGLSBC-UHFFFAOYSA-N
SMILES C1(CCCO1)COC(C=1C=CC=CC1C(OCC)=O)=O