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N-(CYANOMETHYL)-DIMETHYLAMMONIUM-TRIFLUOROMETHANESULFONATE

View entire compound with spectra: 1 NMR

N-(CYANOMETHYL)-DIMETHYLAMMONIUM-TRIFLUOROMETHANESULFONATE
SpectraBase Compound ID 484c9WHtID8
InChI InChI=1S/C4H8N2.CHF3O3S/c1-6(2)4-3-5;2-1(3,4)8(5,6)7/h4H2,1-2H3;(H,5,6,7)
InChIKey MOKKMYFSTPXQKE-UHFFFAOYSA-N
Mol Weight 234.19 g/mol
Molecular Formula C5H9F3N2O3S
Exact Mass 234.028598 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LUrR0sSDTEx
Name N-(CYANOMETHYL)-DIMETHYLAMMONIUM-TRIFLUOROMETHANESULFONATE
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H9F3N2O3S
InChI InChI=1S/C4H8N2.CHF3O3S/c1-6(2)4-3-5;2-1(3,4)8(5,6)7/h4H2,1-2H3;(H,5,6,7)
InChIKey MOKKMYFSTPXQKE-UHFFFAOYSA-N
Literature Reference Author N.OKA,T.WADA,K.SAIGO
Literature Reference Citation J.AM.CHEM.SOC.,125,8307(2003)
Literature Reference DOI 10.1021/ja034502z
Molecular Weight 234.193 g/mol
Sample ID 41767
Solvent CD3CN