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1-(3,5-Dimethoxyphenoxy)-7-Methoxy-2,4,9-trihydroxydibenzo-1,4-dioxin
SpectraBase Compound ID 3RNkeA9krsc
InChI InChI=1S/C21H18O9/c1-25-10-4-11(26-2)6-13(5-10)28-19-15(23)9-16(24)20-21(19)30-18-14(22)7-12(27-3)8-17(18)29-20/h4-9,22-24H,1-3H3
InChIKey SDTJKGLLNINTIU-UHFFFAOYSA-N
Mol Weight 414.37 g/mol
Molecular Formula C21H18O9
Exact Mass 414.095082 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVzdojgLAWw
Name 1-(3,5-Dimethoxyphenoxy)-7-Methoxy-2,4,9-trihydroxydibenzo-1,4-dioxin
Alternate Name(s) 4-(3,5-dimethoxyphenoxy)-8-methoxydibenzo[b,e][1,4]dioxin-1,3,6-triol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18O9
InChI InChI=1S/C21H18O9/c1-25-10-4-11(26-2)6-13(5-10)28-19-15(23)9-16(24)20-21(19)30-18-14(22)7-12(27-3)8-17(18)29-20/h4-9,22-24H,1-3H3
InChIKey SDTJKGLLNINTIU-UHFFFAOYSA-N
Molecular Weight 414.366 g/mol
SMILES Oc1c2c(Oc3c(c(c(cc3O)O)Oc3cc(OC)cc(c3)OC)O2)cc(c1)OC
SPLASH splash10-03di-0010900000-d79cc7c8694971326ecc
Source of Spectrum E1-37-351-1
Wiley ID 1517592