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4-(4-Dodecyl)-benzenesulfonic acid, anion

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4-(4-Dodecyl)-benzenesulfonic acid, anion
SpectraBase Compound ID HFz3e6F0TyN
InChI InChI=1S/C18H30O3S/c1-3-5-6-7-8-9-11-16(10-4-2)17-12-14-18(15-13-17)22(19,20)21/h12-16H,3-11H2,1-2H3,(H,19,20,21)/p-1
InChIKey YNJLGQRDQAQAHR-UHFFFAOYSA-M
Mol Weight 325.49 g/mol
Molecular Formula C18H29O3S
Exact Mass 325.183741 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kn73VMKZuAw
Name 4-(4-Dodecyl)-benzenesulfonic acid, anion
Comments sodium salt
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Formula C18H29O3S
InChI InChI=1S/C18H30O3S/c1-3-5-6-7-8-9-11-16(10-4-2)17-12-14-18(15-13-17)22(19,20)21/h12-16H,3-11H2,1-2H3,(H,19,20,21)/p-1
InChIKey YNJLGQRDQAQAHR-UHFFFAOYSA-M
Instrument Name Bruker WP-200
Literature Reference C. Millot, J. Brondeau, D. Canet, Magn. Res. Chem. 24, 648 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O