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6-chloro-4-hydroxy-5,8-diketo-naphthalene-2-carboxylic acid ethyl ester
SpectraBase Compound ID A7ML36xCB4X
InChI InChI=1S/C13H9ClO5/c1-2-19-13(18)6-3-7-9(15)5-8(14)12(17)11(7)10(16)4-6/h3-5,16H,2H2,1H3
InChIKey SQKICFVGYDFXDS-UHFFFAOYSA-N
Mol Weight 280.66 g/mol
Molecular Formula C13H9ClO5
Exact Mass 280.013851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A7i6IsMmWkm
Name 6-chloro-4-hydroxy-5,8-diketo-naphthalene-2-carboxylic acid ethyl ester
Alternate Name(s) 6-chloro-4-hydroxy-5,8-dioxo-2-naphthalenecarboxylic acid ethyl ester ethyl 6-chloranyl-4-oxidanyl-5,8-bis(oxidanylidene)naphthalene-2-carboxylate ethyl 6-chloro-4-hydroxy-5,8-dioxo-naphthalene-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C13H9ClO5
InChI InChI=1S/C13H9ClO5/c1-2-19-13(18)6-3-7-9(15)5-8(14)12(17)11(7)10(16)4-6/h3-5,16H,2H2,1H3
InChIKey SQKICFVGYDFXDS-UHFFFAOYSA-N
Molecular Weight 280.663 g/mol
SMILES Oc1c2c(C(=O)C=C(C2=O)Cl)cc(c1)C(=O)OCC
SPLASH splash10-001r-0090000000-a9560c1ca4f8ba8690f5
Source of Spectrum J-58-7910-6
Wiley ID 1283494