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4'-Hydroxy-2'-methyl-3,4,5-trimethoxychalcone, 2-methylpropionate
SpectraBase Compound ID IzGdweHnLqk
InChI InChI=1S/C23H26O6/c1-14(2)23(25)29-17-8-9-18(15(3)11-17)19(24)10-7-16-12-20(26-4)22(28-6)21(13-16)27-5/h7-14H,1-6H3/b10-7+
InChIKey KTLQBKISIRDCFI-JXMROGBWSA-N
Mol Weight 398.46 g/mol
Molecular Formula C23H26O6
Exact Mass 398.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jm3VWzNHpPP
Name 4'-Hydroxy-2'-methyl-3,4,5-trimethoxychalcone, 2-methylpropionate
Comments Computed using HOSE algorithm
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Exact Mass 398.172938551 u
Formula C23H26O6
InChI InChI=1S/C23H26O6/c1-14(2)23(25)29-17-8-9-18(15(3)11-17)19(24)10-7-16-12-20(26-4)22(28-6)21(13-16)27-5/h7-14H,1-6H3/b10-7+
InChIKey KTLQBKISIRDCFI-JXMROGBWSA-N
Molecular Weight 398.455 g/mol
SMILES C1(=CC=C(C=C1C)OC(C(C)C)=O)C(\C=C\C1=CC(=C(C(=C1)OC)OC)OC)=O