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2'Ethoxy-3,4,4',5-tetramethoxychalcone (isomer 2)
SpectraBase Compound ID KHqkdjAaOf9
InChI InChI=1S/C21H24O6/c1-6-27-18-13-15(23-2)8-9-16(18)17(22)10-7-14-11-19(24-3)21(26-5)20(12-14)25-4/h7-13H,6H2,1-5H3/b10-7+
InChIKey BXWYOIFAWDOQLL-JXMROGBWSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H24O6
Exact Mass 372.157288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LiwtvJRCsx5
Name 2'Ethoxy-3,4,4',5-tetramethoxychalcone (isomer 2)
Comments Computed using HOSE algorithm
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Exact Mass 372.157288487 u
Formula C21H24O6
InChI InChI=1S/C21H24O6/c1-6-27-18-13-15(23-2)8-9-16(18)17(22)10-7-14-11-19(24-3)21(26-5)20(12-14)25-4/h7-13H,6H2,1-5H3/b10-7+
InChIKey BXWYOIFAWDOQLL-JXMROGBWSA-N
Molecular Weight 372.417 g/mol
SMILES C1(=C(C=C(C=C1)OC)OCC)C(\C=C\C=1C=C(OC)C(OC)=C(OC)C1)=O