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2',4-Dihydroxy-4',6'-dimethoxychalcone, bis(2-methylpropionate)
SpectraBase Compound ID 8bK1cJY1Y36
InChI InChI=1S/C25H28O7/c1-15(2)24(27)31-18-10-7-17(8-11-18)9-12-20(26)23-21(30-6)13-19(29-5)14-22(23)32-25(28)16(3)4/h7-16H,1-6H3/b12-9+
InChIKey OMTQWUYQGIKAEE-FMIVXFBMSA-N
Mol Weight 440.49 g/mol
Molecular Formula C25H28O7
Exact Mass 440.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6tG56Qk9h1l
Name 2',4-Dihydroxy-4',6'-dimethoxychalcone, bis(2-methylpropionate)
Comments Computed using HOSE algorithm
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Exact Mass 440.183503235 u
Formula C25H28O7
InChI InChI=1S/C25H28O7/c1-15(2)24(27)31-18-10-7-17(8-11-18)9-12-20(26)23-21(30-6)13-19(29-5)14-22(23)32-25(28)16(3)4/h7-16H,1-6H3/b12-9+
InChIKey OMTQWUYQGIKAEE-FMIVXFBMSA-N
Molecular Weight 440.492 g/mol
SMILES C1(=C(C=C(C=C1OC(C(C)C)=O)OC)OC)C(\C=C\C1=CC=C(C=C1)OC(C(C)C)=O)=O