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Benzyldimethylstearylammonium chloride monohydrate
SpectraBase Compound ID 4yHFbZUWlxR
InChI InChI=1S/C27H50N.ClH.H2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28(2,3)26-27-23-20-19-21-24-27;;/h19-21,23-24H,4-18,22,25-26H2,1-3H3;1H;1H2/q+1;;/p-1
InChIKey MEAWKEQKQGFJHS-UHFFFAOYSA-M
Mol Weight 442.17 g/mol
Molecular Formula C27H52ClNO
Exact Mass 441.373743 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AaAlBhhPBKe
Name Benzyldimethylstearylammonium chloride monohydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 229016
CAS Registry Number 206752-43-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H52ClNO
InChI InChI=1S/C27H50N.ClH.H2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28(2,3)26-27-23-20-19-21-24-27;;/h19-21,23-24H,4-18,22,25-26H2,1-3H3;1H;1H2/q+1;;/p-1
InChIKey MEAWKEQKQGFJHS-UHFFFAOYSA-M
Observed nucleus 1H
Purity 90%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_003488