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N-(CYANOMETHYL)-PIPERIDINIUM-TRIFLUOROMETHANESULFONATE

View entire compound with spectra: 1 NMR

N-(CYANOMETHYL)-PIPERIDINIUM-TRIFLUOROMETHANESULFONATE
SpectraBase Compound ID 4IEcHDo1F9b
InChI InChI=1S/C7H12N2.CHF3O3S/c8-4-7-9-5-2-1-3-6-9;2-1(3,4)8(5,6)7/h1-3,5-7H2;(H,5,6,7)
InChIKey DUSHQROJSFJSPX-UHFFFAOYSA-N
Mol Weight 274.26 g/mol
Molecular Formula C8H13F3N2O3S
Exact Mass 274.059898 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DsfvDrEt2wY
Name N-(CYANOMETHYL)-PIPERIDINIUM-TRIFLUOROMETHANESULFONATE
Compound Number 1J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H13F3N2O3S
InChI InChI=1S/C7H12N2.CHF3O3S/c8-4-7-9-5-2-1-3-6-9;2-1(3,4)8(5,6)7/h1-3,5-7H2;(H,5,6,7)
InChIKey DUSHQROJSFJSPX-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 274.258 g/mol
Sample ID 41769
Solvent CD3CN