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5-METHYL-3-({[5-(DIMETHYLAMINO)-NAPHTHALENE-1-SULFONYL]-METHYL)-HEXANOIC_ACID
SpectraBase Compound ID 2vsuysIHQUN
InChI InChI=1S/C20H28N2O4S/c1-14(2)11-15(12-20(23)24)13-21-27(25,26)19-10-6-7-16-17(19)8-5-9-18(16)22(3)4/h5-10,14-15,21H,11-13H2,1-4H3,(H,23,24)
InChIKey WGAOBHKRDHXHSC-UHFFFAOYSA-N
Mol Weight 392.51 g/mol
Molecular Formula C20H28N2O4S
Exact Mass 392.176979 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ka9ZYSvZ9QM
Name 5-METHYL-3-({[5-(DIMETHYLAMINO)-NAPHTHALENE-1-SULFONYL]-METHYL)-HEXANOIC_ACID
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28N2O4S
InChI InChI=1S/C20H28N2O4S/c1-14(2)11-15(12-20(23)24)13-21-27(25,26)19-10-6-7-16-17(19)8-5-9-18(16)22(3)4/h5-10,14-15,21H,11-13H2,1-4H3,(H,23,24)
InChIKey WGAOBHKRDHXHSC-UHFFFAOYSA-N
Literature Reference Author S.BENI,T.SOHAJDA,G.NEUMAJER,R.IVANYI,L.SZENTE,B.NOSZAL
Literature Reference Citation J.PHARM.BIOM.ANAL.,51,842(2010)
Literature Reference DOI 10.1016/j.jpba.2009.10.010
Molecular Weight 392.513 g/mol
Solvent CDCl3
Source File Reference UWMZ44202