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1-METHYL-4-AMINOPYRIDINIUM-TRIFLATE

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1-METHYL-4-AMINOPYRIDINIUM-TRIFLATE
SpectraBase Compound ID 99TQ6bY4GVw
InChI InChI=1S/C6H8N2.CHF3O3S/c1-8-4-2-6(7)3-5-8;2-1(3,4)8(5,6)7/h2-5,7H,1H3;(H,5,6,7)
InChIKey RTURJWDBMCTJJK-UHFFFAOYSA-N
Mol Weight 258.22 g/mol
Molecular Formula C7H9F3N2O3S
Exact Mass 258.028598 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 13cGwVTscwQ
Name 1-METHYL-4-AMINOPYRIDINIUM-TRIFLATE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H9F3N2O3S
InChI InChI=1S/C6H8N2.CHF3O3S/c1-8-4-2-6(7)3-5-8;2-1(3,4)8(5,6)7/h2-5,7H,1H3;(H,5,6,7)
InChIKey RTURJWDBMCTJJK-UHFFFAOYSA-N
Literature Reference Author A.ABBOTTO,S.BRADAMANTE,G.A.PAGANI
Literature Reference Citation J.ORG.CHEM.,66,8883(2001)
Literature Reference DOI 10.1021/jo015937c
Molecular Weight 258.215 g/mol
Solvent DMSO-D6
Source File Reference UWLU29287