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9'-O-Methylvibsanol
SpectraBase Compound ID 9PDM4Q0yg50
InChI InChI=1S/C20H20O6/c1-24-11-15-14-8-12(4-3-7-21)9-17(23)20(14)26-19(15)13-5-6-16(22)18(10-13)25-2/h3-6,8-10,21-23H,7,11H2,1-2H3/b4-3+
InChIKey VSJXKWCBZNUAQF-ONEGZZNKSA-N
Mol Weight 356.37 g/mol
Molecular Formula C20H20O6
Exact Mass 356.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9IpVEvwGltq
Name 9'-O-Methylvibsanol
Alternate Name(s) 2-(4-hydroxy-3-methoxyphenyl)-5-[(E)-3-hydroxyprop-1-enyl]-3-(methoxymethyl)-7-benzofuranol 2-(4-hydroxy-3-methoxyphenyl)-5-[(E)-3-hydroxyprop-1-enyl]-3-(methoxymethyl)-1-benzofuran-7-ol 3-(methoxymethyl)-2-(3-methoxy-4-oxidanyl-phenyl)-5-[(E)-3-oxidanylprop-1-enyl]-1-benzofuran-7-ol
Comments Less than 3 mono-isotopic peaks
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Formula C20H20O6
InChI InChI=1S/C20H20O6/c1-24-11-15-14-8-12(4-3-7-21)9-17(23)20(14)26-19(15)13-5-6-16(22)18(10-13)25-2/h3-6,8-10,21-23H,7,11H2,1-2H3/b4-3+
InChIKey VSJXKWCBZNUAQF-ONEGZZNKSA-N
Molecular Weight 356.374 g/mol
SMILES OC\C=C\c1cc2c(c(-c3ccc(c(c3)OC)O)oc2c(c1)O)COC
SPLASH splash10-0a4i-0009000000-e6e22a3c2a5ff4e86a52
Source of Spectrum E1-44-1420-2
Wiley ID 1553481