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2'-(3-Methylbutyl)oxy-3,4,4',6'-tetramethoxychalcone (isomer 1)

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2'-(3-Methylbutyl)oxy-3,4,4',6'-tetramethoxychalcone (isomer 1)
SpectraBase Compound ID 8FU37fdrIqJ
InChI InChI=1S/C24H30O6/c1-16(2)11-12-30-23-15-18(26-3)14-22(29-6)24(23)19(25)9-7-17-8-10-20(27-4)21(13-17)28-5/h7-10,13-16H,11-12H2,1-6H3/b9-7+
InChIKey OWIFDMMSYLQAQK-VQHVLOKHSA-N
Mol Weight 414.5 g/mol
Molecular Formula C24H30O6
Exact Mass 414.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ELKFWcp3DXK
Name 2'-(3-Methylbutyl)oxy-3,4,4',6'-tetramethoxychalcone (isomer 1)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.204238680 u
Formula C24H30O6
InChI InChI=1S/C24H30O6/c1-16(2)11-12-30-23-15-18(26-3)14-22(29-6)24(23)19(25)9-7-17-8-10-20(27-4)21(13-17)28-5/h7-10,13-16H,11-12H2,1-6H3/b9-7+
InChIKey OWIFDMMSYLQAQK-VQHVLOKHSA-N
Molecular Weight 414.498 g/mol
SMILES C1(=C(C=C(C=C1OC)OC)OCCC(C)C)C(\C=C\C=1C=CC(OC)=C(OC)C1)=O