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Picolinic acid, 3,4,5-trichloro-6-(p-toluene sulfonyl)-, methyl ester
SpectraBase Compound ID D5kXdZnFDB1
InChI InChI=1S/C14H10Cl3NO4S/c1-7-3-5-8(6-4-7)23(20,21)13-11(17)9(15)10(16)12(18-13)14(19)22-2/h3-6H,1-2H3
InChIKey FZFLRPXJTQPWNI-UHFFFAOYSA-N
Mol Weight 394.66 g/mol
Molecular Formula C14H10Cl3NO4S
Exact Mass 392.939612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HoQHKVNQGv
Name Picolinic acid, 3,4,5-trichloro-6-(p-toluene sulfonyl)-, methyl ester
Alternate Name(s) Methyl 3,4,5-trichloro-6-[(4-methylphenyl)sulfonyl]-2-pyridinecarboxylate
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Formula C14H10Cl3NO4S
InChI InChI=1S/C14H10Cl3NO4S/c1-7-3-5-8(6-4-7)23(20,21)13-11(17)9(15)10(16)12(18-13)14(19)22-2/h3-6H,1-2H3
InChIKey FZFLRPXJTQPWNI-UHFFFAOYSA-N
Molecular Weight 394.656 g/mol
SMILES c1(S(c2ccc(cc2)C)(=O)=O)c(c(Cl)c(c(n1)C(=O)OC)Cl)Cl
SPLASH splash10-036u-8289000000-cbf3b05b6108985fc2f4
Source of Spectrum RB-1982-11773-0
Wiley ID 120331