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2,3-Dimethoxy-2'-hydroxychalcone, 2-methylpropionate
SpectraBase Compound ID 3oUre9IobeW
InChI InChI=1S/C21H22O5/c1-14(2)21(23)26-18-10-6-5-9-16(18)17(22)13-12-15-8-7-11-19(24-3)20(15)25-4/h5-14H,1-4H3/b13-12+
InChIKey ZENNTEJAQHPRCS-OUKQBFOZSA-N
Mol Weight 354.4 g/mol
Molecular Formula C21H22O5
Exact Mass 354.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2m3jZSRxXtC
Name 2,3-Dimethoxy-2'-hydroxychalcone, 2-methylpropionate
Comments Computed using HOSE algorithm
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Exact Mass 354.146723803 u
Formula C21H22O5
InChI InChI=1S/C21H22O5/c1-14(2)21(23)26-18-10-6-5-9-16(18)17(22)13-12-15-8-7-11-19(24-3)20(15)25-4/h5-14H,1-4H3/b13-12+
InChIKey ZENNTEJAQHPRCS-OUKQBFOZSA-N
Molecular Weight 354.402 g/mol
SMILES C1(=CC=CC=C1OC(C(C)C)=O)C(\C=C\C1=CC=CC(=C1OC)OC)=O