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[CIS-2-(N,N-DIMETHYLAMINO)-CYCLOPENTYL]-TRIMETHYLAMMONIUM-TRIFLUOROMETHANESULFONATE

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[CIS-2-(N,N-DIMETHYLAMINO)-CYCLOPENTYL]-TRIMETHYLAMMONIUM-TRIFLUOROMETHANESULFONATE
SpectraBase Compound ID EIyH0XxuJgp
InChI InChI=1S/2C10H23N2.2CHF3O3S/c2*1-11(2)9-7-6-8-10(9)12(3,4)5;2*2-1(3,4)8(5,6)7/h2*9-10H,6-8H2,1-5H3;2*(H,5,6,7)/q2*+1;;/p-2/t2*9-,10+;;/m00../s1
InChIKey TZVCFMRZHUTZDX-DCIXTLBSSA-L
Mol Weight 640.74 g/mol
Molecular Formula C22H46F6N4O6S2
Exact Mass 640.276297 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GloK4VNhaeh
Name [CIS-2-(N,N-DIMETHYLAMINO)-CYCLOPENTYL]-TRIMETHYLAMMONIUM-TRIFLUOROMETHANESULFONATE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H46F6N4O6S2
InChI InChI=1S/2C10H23N2.2CHF3O3S/c2*1-11(2)9-7-6-8-10(9)12(3,4)5;2*2-1(3,4)8(5,6)7/h2*9-10H,6-8H2,1-5H3;2*(H,5,6,7)/q2*+1;;/p-2/t2*9-,10+;;/m00../s1
InChIKey TZVCFMRZHUTZDX-DCIXTLBSSA-L
Literature Reference Author G.FRAENKEL,S.BOYD,A.CHOW,J.GALLUCCI
Literature Reference Citation J.AM.CHEM.SOC.,118,12804(1996)
Literature Reference DOI 10.1021/ja962327z
Molecular Weight 640.741 g/mol
Sample ID 54530
Solvent D2O