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

View entire compound with spectra: 1 NMR, and 1 FTIR

2'-(2-Methylpropyl)oxy-3,4,4',6'-tetramethoxychalcone (isomer 2)
SpectraBase Compound ID I8WwDzXtojj
InChI InChI=1S/C23H28O6/c1-15(2)14-29-22-13-17(25-3)12-21(28-6)23(22)18(24)9-7-16-8-10-19(26-4)20(11-16)27-5/h7-13,15H,14H2,1-6H3/b9-7+
InChIKey FUXDOHKNWSHMKA-VQHVLOKHSA-N
Mol Weight 400.47 g/mol
Molecular Formula C23H28O6
Exact Mass 400.188589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5ezCsI8RsQh
Name 2'-(2-Methylpropyl)oxy-3,4,4',6'-tetramethoxychalcone (isomer 2)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.188588616 u
Formula C23H28O6
InChI InChI=1S/C23H28O6/c1-15(2)14-29-22-13-17(25-3)12-21(28-6)23(22)18(24)9-7-16-8-10-19(26-4)20(11-16)27-5/h7-13,15H,14H2,1-6H3/b9-7+
InChIKey FUXDOHKNWSHMKA-VQHVLOKHSA-N
Molecular Weight 400.471 g/mol
SMILES C1(=C(C=C(C=C1OC)OC)OCC(C)C)C(\C=C\C=1C=CC(OC)=C(OC)C1)=O