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1-(3,4-DIHYDRO-2H-PYRROL-5-YL)-PYRIDINIUM-TRIFLUOROMETHANESULFONATE
SpectraBase Compound ID 4vh28b4wMiU
InChI InChI=1S/C9H11N2.CHF3O3S/c1-2-7-11(8-3-1)9-5-4-6-10-9;2-1(3,4)8(5,6)7/h1-3,7-8H,4-6H2;(H,5,6,7)/q+1;/p-1
InChIKey PRTJVKUAXPQUSO-UHFFFAOYSA-M
Mol Weight 296.26 g/mol
Molecular Formula C10H11F3N2O3S
Exact Mass 296.044248 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 78foaUvbm8c
Name 1-(3,4-DIHYDRO-2H-PYRROL-5-YL)-PYRIDINIUM-TRIFLUOROMETHANESULFONATE
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H11F3N2O3S
InChI InChI=1S/C9H11N2.CHF3O3S/c1-2-7-11(8-3-1)9-5-4-6-10-9;2-1(3,4)8(5,6)7/h1-3,7-8H,4-6H2;(H,5,6,7)/q+1;/p-1
InChIKey PRTJVKUAXPQUSO-UHFFFAOYSA-M
Literature Reference Author A.B.CHARETTE,S.MATHIEU,J.MARTEL
Literature Reference Citation ORG.LETTERS,7,5401(2005)
Literature Reference DOI 10.1021/ol052069n
Molecular Weight 296.264 g/mol
Sample ID 62860
Solvent ACETONE-D6