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Dibenzothiophene-4-carboxylic acid
SpectraBase Compound ID E9mvau0UqDZ
InChI InChI=1S/C13H8O2S/c14-13(15)10-6-3-5-9-8-4-1-2-7-11(8)16-12(9)10/h1-7H,(H,14,15)
InChIKey WHDBZUDFOQNASQ-UHFFFAOYSA-N
Mol Weight 228.26 g/mol
Molecular Formula C13H8O2S
Exact Mass 228.024501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 79gzEYsvRVA
Name Dibenzothiophene-4-carboxylic acid
Alternate Name(s) 4-dibenzothiophenecarboxylic acid dibenzo[b,d]thiophene-4-carboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C13H8O2S
InChI InChI=1S/C13H8O2S/c14-13(15)10-6-3-5-9-8-4-1-2-7-11(8)16-12(9)10/h1-7H,(H,14,15)
InChIKey WHDBZUDFOQNASQ-UHFFFAOYSA-N
Molecular Weight 228.265 g/mol
SMILES OC(c1c2c(c3c(s2)cccc3)ccc1)=O
SPLASH splash10-004i-0290000000-4df19655db77b41d6b17
Source of Spectrum KC-0-461-4
Wiley ID 824212