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5-(5-Chloranyl-4-methyl-2-oxidanyl-phenyl)carbonyl-2-oxidanyl-benzoic acid
SpectraBase Compound ID 3TKefuwXOZT
InChI InChI=1S/C15H11ClO5/c1-7-4-13(18)9(6-11(7)16)14(19)8-2-3-12(17)10(5-8)15(20)21/h2-6,17-18H,1H3,(H,20,21)
InChIKey ASLMANRUEZXUEQ-UHFFFAOYSA-N
Mol Weight 306.7 g/mol
Molecular Formula C15H11ClO5
Exact Mass 306.029501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YsG4HoSUL2
Name 5-(5-Chloranyl-4-methyl-2-oxidanyl-phenyl)carbonyl-2-oxidanyl-benzoic acid
Alternate Name(s) 5-(5-Chloro-2-hydroxy-4-methyl-benzoyl)-2-hydroxy-benzoic acid 5-[(5-chloro-2-hydroxy-4-methylphenyl)-oxomethyl]-2-hydroxybenzoic acid
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Formula C15H11ClO5
InChI InChI=1S/C15H11ClO5/c1-7-4-13(18)9(6-11(7)16)14(19)8-2-3-12(17)10(5-8)15(20)21/h2-6,17-18H,1H3,(H,20,21)
InChIKey ASLMANRUEZXUEQ-UHFFFAOYSA-N
Molecular Weight 306.701 g/mol
SMILES Oc1ccc(C(c2c(cc(c(c2)Cl)C)O)=O)cc1C(=O)O
SPLASH splash10-066r-2906000000-f49881185496998a65f9
Source of Spectrum K1-0-3643-4
Wiley ID 1589288