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5-nitro-2-[p-(1,1,3,3-tetramethylbutyl)phenoxy]benzenesulfonic acid
SpectraBase Compound ID CAA4PApzUWa
InChI InChI=1S/C20H25NO6S/c1-19(2,3)13-20(4,5)14-6-9-16(10-7-14)27-17-11-8-15(21(22)23)12-18(17)28(24,25)26/h6-12H,13H2,1-5H3,(H,24,25,26)
InChIKey WCDGUQYZUYGEED-UHFFFAOYSA-N
Mol Weight 407.48 g/mol
Molecular Formula C20H25NO6S
Exact Mass 407.140259 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ykEtantsAE
Name 5-nitro-2-[p-(1,1,3,3-tetramethylbutyl)phenoxy]benzenesulfonic acid
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Formula C20H25NO6S
InChI InChI=1S/C20H25NO6S/c1-19(2,3)13-20(4,5)14-6-9-16(10-7-14)27-17-11-8-15(21(22)23)12-18(17)28(24,25)26/h6-12H,13H2,1-5H3,(H,24,25,26)
InChIKey WCDGUQYZUYGEED-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 37504M
Solvent Polysol