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Suberyldicholine dichloride

View entire compound with spectra: 2 NMR, and 1 FTIR

Suberyldicholine dichloride
SpectraBase Compound ID HCypFdt5kva
InChI InChI=1S/C18H38N2O4.2ClH/c1-19(2,3)13-15-23-17(21)11-9-7-8-10-12-18(22)24-16-14-20(4,5)6;;/h7-16H2,1-6H3;2*1H/q+2;;/p-2
InChIKey MGNXGLROGDRCGJ-UHFFFAOYSA-L
Mol Weight 417.42 g/mol
Molecular Formula C18H38Cl2N2O4
Exact Mass 416.220863 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Kq3lZWFDbER
Name Suberyldicholine dichloride
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 862045
CAS Registry Number 100930-12-9
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H38Cl2N2O4
InChI InChI=1S/C18H38N2O4.2ClH/c1-19(2,3)13-15-23-17(21)11-9-7-8-10-12-18(22)24-16-14-20(4,5)6;;/h7-16H2,1-6H3;2*1H/q+2;;/p-2
InChIKey MGNXGLROGDRCGJ-UHFFFAOYSA-L
Observed nucleus 13C
Purity 97%
Solvent D2O
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 2,2'-[(1,8-Dioxo-1,8-octanediyl)bis(oxy)]bis[N,N,N-trimethylethanaminium Dichloride
Wiley ID SIAL_13CNMR_010579