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3-[2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-hydroxy-4-methoxyphenyl]-1-(2-hydroxy-4-methoxyphenyl)propan-1-one
SpectraBase Compound ID 5Zzq7fQh0f5
InChI InChI=1S/C27H34O5/c1-18(2)7-6-8-19(3)9-13-22-20(11-16-26(32-5)27(22)30)10-15-24(28)23-14-12-21(31-4)17-25(23)29/h7,9,11-12,14,16-17,29-30H,6,8,10,13,15H2,1-5H3/b19-9+
InChIKey DYWYNIZAPQUEBO-DJKKODMXSA-N
Mol Weight 438.6 g/mol
Molecular Formula C27H34O5
Exact Mass 438.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J5UebQrOBNz
Name 3-[2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-hydroxy-4-methoxyphenyl]-1-(2-hydroxy-4-methoxyphenyl)propan-1-one
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H34O5
InChI InChI=1S/C27H34O5/c1-18(2)7-6-8-19(3)9-13-22-20(11-16-26(32-5)27(22)30)10-15-24(28)23-14-12-21(31-4)17-25(23)29/h7,9,11-12,14,16-17,29-30H,6,8,10,13,15H2,1-5H3/b19-9+
InChIKey DYWYNIZAPQUEBO-DJKKODMXSA-N
Literature Reference Author S.MCLEAN,W.F.REYNOLDS,W.F.TINTO,W.R.CHAN,V.SHEPHERD
Literature Reference Citation MAGN.RES.CHEM.,34,719(1996)
Literature Reference DOI 10.1002/(sici)1097-458x(199609)34:9<719::aid-omr948>3.3.co;2-h
Molecular Weight 438.564 g/mol
Solvent CDCl3
Source File Reference UWCP2357