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diethyl(2-hydroxyethyl)methylammnoium bromide, 2-[(1-chloro-2-naphthyl)oxy]-2-methylpropionate
SpectraBase Compound ID 4GUwNrfp9ki
InChI InChI=1S/C21H29ClNO3.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 CTAGJAKSTBJSRU-UHFFFAOYSA-M
Mol Weight 458.82 g/mol
Molecular Formula C21H29BrClNO3
Exact Mass 457.101934 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID AUwrgrQWWXh
Name DIETHYL(2-HYDROXYETHYL)METHYLAMMONIUM BROMIDE, 2-[(1-CHLORO-2-NAPHTHYL)OXY]-2-METHYLPROPIONATE
Source of Sample V. PESTELLINI, A. MENARINI PHARMACEUTICALS, FLORENCE, ITALY
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29BrClNO3
InChI InChI=1S/C21H29ClNO3.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 CTAGJAKSTBJSRU-UHFFFAOYSA-M
Literature Reference EUR. J. MED. CHEM.-CHIM. THER. 12, 466(1977) Abstract-Chemical Abstracts= 88, 37470(1978)
Melting Point 155-157C
Molecular Weight 458.826996
Synonyms AMMONIUM BROMIDE, DIETHYL- /2-HYDROXYETHYL/METHYL-, 2-//1-CHLORO- 2-NAPHTHYL/OXY/-2-METHYLPROPIONATE
Technique KBr WAFER