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2-Iodo-5-octyloxy-benzoic acid, anion

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2-Iodo-5-octyloxy-benzoic acid, anion
SpectraBase Compound ID 1c2O2bF4wd
InChI InChI=1S/C15H21IO3/c1-2-3-4-5-6-7-10-19-12-8-9-14(16)13(11-12)15(17)18/h8-9,11H,2-7,10H2,1H3,(H,17,18)/p-1
InChIKey GDEQHDHAKKVJLW-UHFFFAOYSA-M
Mol Weight 375.23 g/mol
Molecular Formula C15H20IO3
Exact Mass 375.045715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5QNJELYj4Fy
Name 2-Iodo-5-octyloxy-benzoic acid, anion
Comments JEOL FX-100 OR VARIAN XL-200 SPECTROMETER SODIUM SALT, DMSO-D6/D20 SOLVENT
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H20IO3
InChI InChI=1S/C15H21IO3/c1-2-3-4-5-6-7-10-19-12-8-9-14(16)13(11-12)15(17)18/h8-9,11H,2-7,10H2,1H3,(H,17,18)/p-1
InChIKey GDEQHDHAKKVJLW-UHFFFAOYSA-M
Instrument Name see comment
Literature Reference A.R. Katritzky, B.L. Duell, J.K.Gallos, Magn. Res. Chem. 27, 1007 (1989).
NMR Standard D2O
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Mixture