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1-(3-hydroxy-4-methylthiophenyl)-2-(2,5-dihydroxyphenylthio)ethanone
SpectraBase Compound ID CPXdNqS0j45
InChI InChI=1S/C15H14O4S2/c1-20-14-5-2-9(6-12(14)18)13(19)8-21-15-7-10(16)3-4-11(15)17/h2-7,16-18H,8H2,1H3
InChIKey QKPPMQAMNDWAHP-UHFFFAOYSA-N
Mol Weight 322.39 g/mol
Molecular Formula C15H14O4S2
Exact Mass 322.033351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UtHhQzEc3Y
Name 1-(3-hydroxy-4-methylthiophenyl)-2-(2,5-dihydroxyphenylthio)ethanone
Alternate Name(s) 2-[(2,5-dihydroxyphenyl)sulfanyl]-1-[3-hydroxy-4-(methylsulfanyl)phenyl]ethanone
Comments Less than 3 mono-isotopic peaks
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Formula C15H14O4S2
InChI InChI=1S/C15H14O4S2/c1-20-14-5-2-9(6-12(14)18)13(19)8-21-15-7-10(16)3-4-11(15)17/h2-7,16-18H,8H2,1H3
InChIKey QKPPMQAMNDWAHP-UHFFFAOYSA-N
Molecular Weight 322.393 g/mol
SMILES Oc1cc(C(CSc2c(ccc(c2)O)O)=O)ccc1SC
SPLASH splash10-014i-0902000000-a61445182d80d71c2d97
Source of Spectrum KC-1993-1365-13
Wiley ID 778057