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2-(dibenzothiophene-2-carbonyl)benzoic acid
SpectraBase Compound ID BYMShqDwqh5
InChI InChI=1S/C20H12O3S/c21-19(14-6-1-2-7-15(14)20(22)23)12-9-10-18-16(11-12)13-5-3-4-8-17(13)24-18/h1-11H,(H,22,23)
InChIKey VQILOYSAQXLEAU-UHFFFAOYSA-N
Mol Weight 332.37 g/mol
Molecular Formula C20H12O3S
Exact Mass 332.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FFrgJCnGe2R
Name 2-(dibenzothiophene-2-carbonyl)benzoic acid
CAS Registry Number 31123-60-1
Comments Less than 3 mono-isotopic peaks
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Formula C20H12O3S
InChI InChI=1S/C20H12O3S/c21-19(14-6-1-2-7-15(14)20(22)23)12-9-10-18-16(11-12)13-5-3-4-8-17(13)24-18/h1-11H,(H,22,23)
InChIKey VQILOYSAQXLEAU-UHFFFAOYSA-N
Molecular Weight 332.373 g/mol
SMILES OC(c1c(C(c2cc3c(sc4c3cccc4)cc2)=O)cccc1)=O
SPLASH splash10-03di-0090000000-257305d48d6c0ea04d71
Source of Spectrum Y-20-865-0
Synonyms 2-(o-carboxybenzoyl)dibenzothiophene 2-dibenzothiophen-2-ylcarbonylbenzoic acid 2-[2-dibenzothiophenyl(oxo)methyl]benzoic acid
Wiley ID 1329532