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diethyl(2-hydroxyethyl)methylammonium bromide, 2-[(1-bromo-2-naphthyl)oxy]-2-methylpropionate
SpectraBase Compound ID JmnatktdqVL
InChI InChI=1S/C21H29BrNO3.BrH/c1-6-23(5,7-2)14-15-25-20(24)21(3,4)26-18-13-12-16-10-8-9-11-17(16)19(18)22;/h8-13H,6-7,14-15H2,1-5H3;1H/q+1;/p-1
InChIKey FNSKWQGPBPVGQB-UHFFFAOYSA-M
Mol Weight 503.28 g/mol
Molecular Formula C21H29Br2NO3
Exact Mass 501.05142 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HD6IpXTJ6ET
Name DIETHYL(2-HYDROXYETHYL)METHYLAMMONIUM BROMIDE, 2-[(1-BROMO-2-NAPHTHYL)OXY]-2-METHYLPROPIONATE
Source of Sample V. Pestellini, A. Menarini Pharmaceuticals, Florence, Italy
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29Br2NO3
InChI InChI=1S/C21H29BrNO3.BrH/c1-6-23(5,7-2)14-15-25-20(24)21(3,4)26-18-13-12-16-10-8-9-11-17(16)19(18)22;/h8-13H,6-7,14-15H2,1-5H3;1H/q+1;/p-1
InChIKey FNSKWQGPBPVGQB-UHFFFAOYSA-M
Melting Point 145-146C
Molecular Weight 503.29
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms AMMONIUM BROMIDE, DIETHYL/2-HYDROXYETHYL/METHYL-, 2-//1-BROMO- 2-NAPHTHYL/OXY/-2-METHYLPROPIONATE