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Methyl 4-[(2'-benzoyloxy-5'-[2"-(1"',3"'-dioxolan-2"'-yl)-4"-methoxyphenoxy](phenetyl)phenoxy}-benzoate
SpectraBase Compound ID 9sMnguaXvCA
InChI InChI=1S/C39H34O9/c1-42-30-16-20-35(33(25-30)39-44-21-22-45-39)47-31-17-19-34(48-37(40)27-9-5-3-6-10-27)28(24-31)15-13-26-14-18-32(38(41)43-2)36(23-26)46-29-11-7-4-8-12-29/h3-12,14,16-20,23-25,39H,13,15,21-22H2,1-2H3
InChIKey SZCXMNFQBYZBEY-UHFFFAOYSA-N
Mol Weight 646.7 g/mol
Molecular Formula C39H34O9
Exact Mass 646.220283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7kKyDTCILY
Name Methyl 4-[(2'-benzoyloxy-5'-[2"-(1"',3"'-dioxolan-2"'-yl)-4"-methoxyphenoxy](phenetyl)phenoxy}-benzoate
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Formula C39H34O9
InChI InChI=1S/C39H34O9/c1-42-30-16-20-35(33(25-30)39-44-21-22-45-39)47-31-17-19-34(48-37(40)27-9-5-3-6-10-27)28(24-31)15-13-26-14-18-32(38(41)43-2)36(23-26)46-29-11-7-4-8-12-29/h3-12,14,16-20,23-25,39H,13,15,21-22H2,1-2H3
InChIKey SZCXMNFQBYZBEY-UHFFFAOYSA-N
Molecular Weight 646.692 g/mol
SMILES c1(c(Oc2cc(CCc3cc(Oc4ccccc4)c(cc3)C(=O)OC)c(OC(=O)c3ccccc3)cc2)ccc(c1)OC)C1OCCO1
SPLASH splash10-0a4i-3900000000-221e7ee165501294fa6c
Source of Spectrum U1-1998-882-18
Wiley ID 751208