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9,10-Anthracenedione, 1-(methylsulfinyl)-
SpectraBase Compound ID IF9qanWyJOU
InChI InChI=1S/C15H10O3S/c1-19(18)12-8-4-7-11-13(12)15(17)10-6-3-2-5-9(10)14(11)16/h2-8H,1H3
InChIKey AIIWIUNUQIVOPB-UHFFFAOYSA-N
Mol Weight 270.3 g/mol
Molecular Formula C15H10O3S
Exact Mass 270.035065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CxrECgVIbek
Name 9,10-Anthracenedione, 1-(methylsulfinyl)-
Alternate Name(s) Anthraquinone, 1-(methylsulfinyl)- 1-(methylsulfinyl)anthra-9,10-quinone 1-(Methylsulfinyl)anthraquinone 1-Anthraquinoyl methyl sulfoxide Methyl 1-anthraquinonesulfenate
CAS Registry Number 2831-71-2
Comments Less than 3 mono-isotopic peaks
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Formula C15H10O3S
InChI InChI=1S/C15H10O3S/c1-19(18)12-8-4-7-11-13(12)15(17)10-6-3-2-5-9(10)14(11)16/h2-8H,1H3
InChIKey AIIWIUNUQIVOPB-UHFFFAOYSA-N
Molecular Weight 270.302 g/mol
SMILES c12C(c3ccccc3C(c2cccc1S(=O)C)=O)=O
SPLASH splash10-000i-0090000000-9655ab2ff4f809da816b
Source of Spectrum J-54-4202-3
Wiley ID 1274076