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4-(9,12-Anthraquinone-2-sulfoxy)phenol
SpectraBase Compound ID Cf6LcLUatQy
InChI InChI=1S/C20H12O6S/c21-12-5-7-13(8-6-12)26-27(24,25)14-9-10-17-18(11-14)20(23)16-4-2-1-3-15(16)19(17)22/h1-11,21H
InChIKey HVQKUEHRMROPDW-UHFFFAOYSA-N
Mol Weight 380.37 g/mol
Molecular Formula C20H12O6S
Exact Mass 380.035459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4L4CSW1LX19
Name 4-(9,12-Anthraquinone-2-sulfoxy)phenol
Comments Less than 3 mono-isotopic peaks
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Formula C20H12O6S
InChI InChI=1S/C20H12O6S/c21-12-5-7-13(8-6-12)26-27(24,25)14-9-10-17-18(11-14)20(23)16-4-2-1-3-15(16)19(17)22/h1-11,21H
InChIKey HVQKUEHRMROPDW-UHFFFAOYSA-N
Molecular Weight 380.370 g/mol
SMILES Oc1ccc(OS(c2cc3C(c4ccccc4C(c3cc2)=O)=O)(=O)=O)cc1
SPLASH splash10-0a4i-0093000000-a43e6602fb46a54fa1fa
Source of Spectrum J-66-4522-14
Synonyms 9,10-dioxo-2-anthracenesulfonic acid (4-hydroxyphenyl) ester (4-hydroxyphenyl) 9,10-dioxoanthracene-2-sulfonate (4-hydroxyphenyl) 9,10-bis(oxidanylidene)anthracene-2-sulfonate
Wiley ID 1535426