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(-)-N-Dodecyl-N-methylephedrinium bromide
SpectraBase Compound ID Kel0gRwFkBt
InChI InChI=1S/C23H42NO.BrH/c1-5-6-7-8-9-10-11-12-13-17-20-24(3,4)21(2)23(25)22-18-15-14-16-19-22;/h14-16,18-19,21,23,25H,5-13,17,20H2,1-4H3;1H/q+1;/p-1/t21-,23-;/m1./s1
InChIKey GOIUTZPQFMGLAH-BLDCTAJRSA-M
Mol Weight 428.5 g/mol
Molecular Formula C23H42BrNO
Exact Mass 427.244978 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CNGgEDPBE9o
Name (-)-N-Dodecyl-N-methylephedrinium bromide
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 235407
CAS Registry Number 57155-63-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H42BrNO
InChI InChI=1S/C23H42NO.BrH/c1-5-6-7-8-9-10-11-12-13-17-20-24(3,4)21(2)23(25)22-18-15-14-16-19-22;/h14-16,18-19,21,23,25H,5-13,17,20H2,1-4H3;1H/q+1;/p-1/t21-,23-;/m1./s1
InChIKey GOIUTZPQFMGLAH-BLDCTAJRSA-M
Observed nucleus 1H
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms (-)-DMEB (1R,2S)-Dodecyl(2-hydroxy-1-methyl-2-phenylethyl)dimethylammonium bromide
Wiley ID SIAL_1HNMR_003689