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ethyl 4,6-dihydroxy-3-methoxy-2-methylbenzoate
SpectraBase Compound ID AjTennPO95Q
InChI InChI=1S/C11H14O5/c1-4-16-11(14)9-6(2)10(15-3)8(13)5-7(9)12/h5,12-13H,4H2,1-3H3
InChIKey UMBVKKVZFZYNPG-UHFFFAOYSA-N
Mol Weight 226.23 g/mol
Molecular Formula C11H14O5
Exact Mass 226.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dFNIc8zbuF
Name ethyl 4,6-dihydroxy-3-methoxy-2-methylbenzoate
Alternate Name(s) 4,6-dihydroxy-3-methoxy-2-methylbenzoic acid ethyl ester ethyl 4,6-dihydroxy-3-methoxy-2-methyl-benzoate ethyl 3-methoxy-2-methyl-4,6-bis(oxidanyl)benzoate
Comments Less than 3 mono-isotopic peaks
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Formula C11H14O5
InChI InChI=1S/C11H14O5/c1-4-16-11(14)9-6(2)10(15-3)8(13)5-7(9)12/h5,12-13H,4H2,1-3H3
InChIKey UMBVKKVZFZYNPG-UHFFFAOYSA-N
Molecular Weight 226.228 g/mol
SMILES Oc1cc(c(c(c1C(=O)OCC)C)OC)O
SPLASH splash10-001i-0920000000-15e1771fdb273327b6ce
Source of Spectrum B-46-95-0
Wiley ID 1227067