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1-Hydroxy-4-(methylthio)naphthalene-2,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 6eglt5QALYD
InChI InChI=1S/C15H14O5S/c1-19-14(17)10-11(15(18)20-2)13(21-3)9-7-5-4-6-8(9)12(10)16/h4-7,16H,1-3H3
InChIKey VPNCBXKTNIVFED-UHFFFAOYSA-N
Mol Weight 306.33 g/mol
Molecular Formula C15H14O5S
Exact Mass 306.056195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HjjJd3jIh7
Name 1-Hydroxy-4-(methylthio)naphthalene-2,3-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 1-methylsulfanyl-4-oxidanyl-naphthalene-2,3-dicarboxylate Dimethyl 1-hydroxy-4-methylsulfanylnaphthalene-2,3-dicarboxylate
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Formula C15H14O5S
InChI InChI=1S/C15H14O5S/c1-19-14(17)10-11(15(18)20-2)13(21-3)9-7-5-4-6-8(9)12(10)16/h4-7,16H,1-3H3
InChIKey VPNCBXKTNIVFED-UHFFFAOYSA-N
Molecular Weight 306.332 g/mol
SMILES Oc1c(c(c(c2c1cccc2)SC)C(=O)OC)C(=O)OC
SPLASH splash10-0a4i-0029000000-508a4bcfbf290098bb33
Source of Spectrum KC-0-592-9
Wiley ID 783234