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(E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-methylpropenoic acid
SpectraBase Compound ID JugVBXVJ86r
InChI InChI=1S/C12H14O5/c1-7(12(14)15)4-8-5-9(16-2)11(13)10(6-8)17-3/h4-6,13H,1-3H3,(H,14,15)/b7-4+
InChIKey ZOCSKJFWHZBIAZ-QPJJXVBHSA-N
Mol Weight 238.24 g/mol
Molecular Formula C12H14O5
Exact Mass 238.084124 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7pMmZyPc2Vt
Name (E)-3-(4-Hydroxy-3,5-dimethoxyphenyl)-2-methylpropenoic acid
Comments Computed using HOSE algorithm
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Exact Mass 238.084123546 u
Formula C12H14O5
InChI InChI=1S/C12H14O5/c1-7(12(14)15)4-8-5-9(16-2)11(13)10(6-8)17-3/h4-6,13H,1-3H3,(H,14,15)/b7-4+
InChIKey ZOCSKJFWHZBIAZ-QPJJXVBHSA-N
Molecular Weight 238.239 g/mol
SMILES C=1(C(=CC(\C=C\(C(=O)O)C)=CC1OC)OC)O