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(2-hydroxytrimethylene)bis[dimethylhexylammonium]dibromide, laurate
SpectraBase Compound ID ImlWaTtEGXF
InChI InChI=1S/C31H66N2O2.2BrH/c1-8-11-14-17-18-19-20-21-22-25-31(34)35-30(28-32(4,5)26-23-15-12-9-2)29-33(6,7)27-24-16-13-10-3;;/h30H,8-29H2,1-7H3;2*1H/q+2;;/p-2
InChIKey UNIGMHZOIXGWPQ-UHFFFAOYSA-L
Mol Weight 658.689 g/mol
Molecular Formula C31H66Br2N2O2
Exact Mass 656.349105 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KK24LRmUKtn
Name (2-HYDROXYTRIMETHYLENE)BIS[DIMETHYLHEXYLAMMONIUM] DIBROMIDE,LAURATE
Source of Sample F. Devinsky, Komensky University, Bratislava, Czechoslovakia
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H66Br2N2O2
InChI InChI=1S/C31H66N2O2.2BrH/c1-8-11-14-17-18-19-20-21-22-25-31(34)35-30(28-32(4,5)26-23-15-12-9-2)29-33(6,7)27-24-16-13-10-3;;/h30H,8-29H2,1-7H3;2*1H/q+2;;/p-2
InChIKey UNIGMHZOIXGWPQ-UHFFFAOYSA-L
Melting Point 174-175C
Molecular Weight 658.70
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms AMMONIUM DIBROMIDE, /2-HYDROXYTRIMETHYLENE/BIS/DIMETHYLHEXYL-, LAURATE