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3,6,7-trichloro-5,8-dihydroxy-3-methyl-tetralin-1,2,4-trione
SpectraBase Compound ID FL7JXKiOgvA
InChI InChI=1S/C11H5Cl3O5/c1-11(14)9(18)3-2(8(17)10(11)19)6(15)4(12)5(13)7(3)16/h15-16H,1H3
InChIKey BQTDSORECIGXBB-UHFFFAOYSA-N
Mol Weight 323.52 g/mol
Molecular Formula C11H5Cl3O5
Exact Mass 321.920256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EfoNh3xkppB
Name 3,6,7-trichloro-5,8-dihydroxy-3-methyl-tetralin-1,2,4-trione
Alternate Name(s) 3,6,7-trichloro-5,8-dihydroxy-3-methylnaphthalene-1,2,4-trione 3,6,7-tris(chloranyl)-3-methyl-5,8-bis(oxidanyl)naphthalene-1,2,4-trione
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Formula C11H5Cl3O5
InChI InChI=1S/C11H5Cl3O5/c1-11(14)9(18)3-2(8(17)10(11)19)6(15)4(12)5(13)7(3)16/h15-16H,1H3
InChIKey BQTDSORECIGXBB-UHFFFAOYSA-N
Molecular Weight 323.515 g/mol
SMILES Oc1c2c(c(c(c1Cl)Cl)O)C(C(C(C2=O)=O)(Cl)C)=O
SPLASH splash10-000i-0090000000-cad37c5b947720ee268c
Source of Spectrum QF-49-470-6
Wiley ID 1547855