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(3-hydroxypropyl)trimethylammonium bromide, 2-methyl-2-[(2-naphthyl)oxy]propionate
SpectraBase Compound ID Ir3Dg1lwJLi
InChI InChI=1S/C20H28NO3.BrH/c1-20(2,19(22)23-14-8-13-21(3,4)5)24-18-12-11-16-9-6-7-10-17(16)15-18;/h6-7,9-12,15H,8,13-14H2,1-5H3;1H/q+1;/p-1
InChIKey JUKMYBBHQZIIND-UHFFFAOYSA-M
Mol Weight 410.35 g/mol
Molecular Formula C20H28BrNO3
Exact Mass 409.125257 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ja2Esxl6ZNg
Name (3-HYDROXYPROPYL)TRIMETHYLAMMONIUM BROMIDE, 2-METHYL-2-[(2-NAPHTHYL)OXY]PROPIONATE
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 C20H28BrNO3
InChI InChI=1S/C20H28NO3.BrH/c1-20(2,19(22)23-14-8-13-21(3,4)5)24-18-12-11-16-9-6-7-10-17(16)15-18;/h6-7,9-12,15H,8,13-14H2,1-5H3;1H/q+1;/p-1
InChIKey JUKMYBBHQZIIND-UHFFFAOYSA-M
Melting Point 130-132C
Molecular Weight 410.36
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms AMMONIUM BROMIDE, /3-HYDROXYPROPYL/TRIMETHYL-, 2-METHYL- 2-//2-NAPHTHYL/OXY/PROPIONATE