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2-[(2-AMINO-alpha,alpha,alpha-TRIFLUORO-p-TOLYL)OXY]-3,5-DICHLOROBENZENESULFONIC ACID, SODIUM SALT
SpectraBase Compound ID 2NxYIQ8W1fg
InChI InChI=1S/C13H8Cl2F3NO4S.Na/c14-7-4-8(15)12(11(5-7)24(20,21)22)23-10-2-1-6(3-9(10)19)13(16,17)18;/h1-5H,19H2,(H,20,21,22);/q;+1/p-1
InChIKey CILFQBWCWWZSTI-UHFFFAOYSA-M
Mol Weight 424.15 g/mol
Molecular Formula C13H7Cl2F3NNaO4S
Exact Mass 422.932263 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DlDkA8KkzQE
Name 2-[2-amino-alpha,alpha,alpha-trifluoro-p-tolyl)oxy]-3,5-dichlorobenzenesulfonic acid, sodium salt
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Formula C13H7Cl2F3NNaO4S
InChI InChI=1S/C13H8Cl2F3NO4S.Na/c14-7-4-8(15)12(11(5-7)24(20,21)22)23-10-2-1-6(3-9(10)19)13(16,17)18;/h1-5H,19H2,(H,20,21,22);/q;+1/p-1
InChIKey CILFQBWCWWZSTI-UHFFFAOYSA-M
Instrument Name Varian CFT-20
Sadtler NMR Number 39500M
Solvent Polysol