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Curcumin - (4-butyl) derivative

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Curcumin - (4-butyl) derivative
SpectraBase Compound ID 2dFAOZzr5hV
InChI InChI=1S/C25H28O6/c1-4-5-14-31-23-13-9-19(16-25(23)30-3)7-11-21(27)17-20(26)10-6-18-8-12-22(28)24(15-18)29-2/h6-13,15-16,28H,4-5,14,17H2,1-3H3/b10-6+,11-7+
InChIKey JUWMSSOJDXYSFU-JMQWPVDRSA-N
Mol Weight 424.49 g/mol
Molecular Formula C25H28O6
Exact Mass 424.188589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BmhaU3cKl7z
Name Curcumin - (4-butyl) derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.188588616 u
Formula C25H28O6
InChI InChI=1S/C25H28O6/c1-4-5-14-31-23-13-9-19(16-25(23)30-3)7-11-21(27)17-20(26)10-6-18-8-12-22(28)24(15-18)29-2/h6-13,15-16,28H,4-5,14,17H2,1-3H3/b10-6+,11-7+
InChIKey JUWMSSOJDXYSFU-JMQWPVDRSA-N
Molecular Weight 424.493 g/mol
SMILES C=1(C(=CC=C(\C=C\C(CC(\C=C\C=2C=C(OC)C(=CC2)OCCCC)=O)=O)C1)O)OC