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threo-1-(4-hydroxy-3-methoxyphenyl)-2- {4-[2-formyl-(E)-vinyl]-2-methoxyphenoxy}-propane-1,3-diol
SpectraBase Compound ID J16nzGrmvQ
InChI InChI=1S/C20H22O7/c1-25-17-11-14(6-7-15(17)23)20(24)19(12-22)27-16-8-5-13(4-3-9-21)10-18(16)26-2/h3-11,19-20,22-24H,12H2,1-2H3/b4-3+/t19-,20-/m1/s1
InChIKey LWLOALZBDOVWAE-FMEUAVTJSA-N
Mol Weight 374.39 g/mol
Molecular Formula C20H22O7
Exact Mass 374.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IMuqaHVi1hL
Name threo-1-(4-hydroxy-3-methoxyphenyl)-2- {4-[2-formyl-(E)-vinyl]-2-methoxyphenoxy}-propane-1,3-diol
Appearance Pale yellow oil
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Formula C20H22O7
InChI InChI=1S/C20H22O7/c1-25-17-11-14(6-7-15(17)23)20(24)19(12-22)27-16-8-5-13(4-3-9-21)10-18(16)26-2/h3-11,19-20,22-24H,12H2,1-2H3/b4-3+/t19-,20-/m1/s1
InChIKey LWLOALZBDOVWAE-FMEUAVTJSA-N
Ionization Type EI
Literature Reference DOI 10.1021/np030117b
Molecular Weight 374.389 g/mol
Reported Formula C20H22O7
SMILES Oc1c(cc([C@]([C@@](CO)(Oc2ccc(cc2OC)\C=C\C=O)[H])(O)[H])cc1)OC
SPLASH splash10-0ufr-3942000000-0507baea4bca3cd019aa
Source of Spectrum G4-66-SM7-17
Wiley ID 1883965