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tetrahexylammonium benzoate

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

tetrahexylammonium benzoate
SpectraBase Compound ID 1AIzYCs0nM0
InChI InChI=1S/C24H52N.C7H6O2/c1-5-9-13-17-21-25(22-18-14-10-6-2,23-19-15-11-7-3)24-20-16-12-8-4;8-7(9)6-4-2-1-3-5-6/h5-24H2,1-4H3;1-5H,(H,8,9)/q+1;/p-1
InChIKey PSEQWFPWQRZBOO-UHFFFAOYSA-M
Mol Weight 475.8 g/mol
Molecular Formula C31H57NO2
Exact Mass 475.43893 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BikFdXKhorh
Name TETRAHEXYLAMMONIUM BENZOATE
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 16436-29-6
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H57NO2
InChI InChI=1S/C24H52N.C7H6O2/c1-5-9-13-17-21-25(22-18-14-10-6-2,23-19-15-11-7-3)24-20-16-12-8-4;8-7(9)6-4-2-1-3-5-6/h5-24H2,1-4H3;1-5H,(H,8,9)/q+1;/p-1
InChIKey PSEQWFPWQRZBOO-UHFFFAOYSA-M
Molecular Weight 475.80
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms AMMONIUM BENZOATE, TETRAHEXYL-,