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Methyl {4-[2'-[4"-{5"'-(1,3-dioxolan-2-yl)-2'''-methoxyphenoxy]phenetyl}-4'-methoxyphenyl}]-3-methoxybenzoate
SpectraBase Compound ID 7lCG7rkZTEE
InChI InChI=1S/C34H34O8/c1-36-27-13-15-28(29-14-9-24(33(35)39-4)20-31(29)38-3)23(19-27)8-5-22-6-11-26(12-7-22)42-32-21-25(10-16-30(32)37-2)34-40-17-18-41-34/h6-7,9-16,19-21,34H,5,8,17-18H2,1-4H3
InChIKey MVZYRSJSXBGHTI-UHFFFAOYSA-N
Mol Weight 570.6 g/mol
Molecular Formula C34H34O8
Exact Mass 570.225368 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2RHKaGHx6mv
Name Methyl {4-[2'-[4''-{5'''-(1,3-dioxolan-2-yl)-2'''-methoxyphenoxy]phenetyl}-4'-methoxyphenyl}]-3-methoxybenzoate
Comments Computed using HOSE algorithm
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Exact Mass 570.225368047 u
Formula C34H34O8
InChI InChI=1S/C34H34O8/c1-36-27-13-15-28(29-14-9-24(33(35)39-4)20-31(29)38-3)23(19-27)8-5-22-6-11-26(12-7-22)42-32-21-25(10-16-30(32)37-2)34-40-17-18-41-34/h6-7,9-16,19-21,34H,5,8,17-18H2,1-4H3
InChIKey MVZYRSJSXBGHTI-UHFFFAOYSA-N
Molecular Weight 570.638 g/mol
SMILES C=1(C2=C(C=C(C=C2)OC)CCC=2C=CC(OC=3C=C(C4OCCO4)C=CC3OC)=CC2)C(=CC(C(=O)OC)=CC1)OC