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2-(6'-N-BUTOXYNAPHTHALEN-2'-YL)-N-METHYLTHIENO-[2,3-C]-PYRIDINIUM-TETRAFLUOROBORATE
SpectraBase Compound ID BQnh4WxP2zm
InChI InChI=1S/C22H22NOS.BF4/c1-3-4-11-24-20-8-7-16-12-18(6-5-17(16)13-20)21-14-19-9-10-23(2)15-22(19)25-21;2-1(3,4)5/h5-10,12-15H,3-4,11H2,1-2H3;/q+1;-1
InChIKey RGDHBHXFNIPOTF-UHFFFAOYSA-N
Mol Weight 435.29 g/mol
Molecular Formula C22H22BF4NOS
Exact Mass 435.145128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KFAvsWW0oRP
Name 2-(6'-N-BUTOXYNAPHTHALEN-2'-YL)-N-METHYLTHIENO-[2,3-C]-PYRIDINIUM-TETRAFLUOROBORATE
Compound Number 15A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22BF4NOS
InChI InChI=1S/C22H22NOS.BF4/c1-3-4-11-24-20-8-7-16-12-18(6-5-17(16)13-20)21-14-19-9-10-23(2)15-22(19)25-21;2-1(3,4)5/h5-10,12-15H,3-4,11H2,1-2H3;/q+1;-1
InChIKey RGDHBHXFNIPOTF-UHFFFAOYSA-N
Literature Reference Author H.NERENZ,M.MEIER,W.GRAHN,A.REISNER,E.SCHMAELZLIN,S.STADLER,K .MEERHOLZ,C.BRAEUCHL
Literature Reference Citation J.CHEM.SOC.PERKIN-2,437(1998)
Literature Reference DOI 10.1039/a703325g
Molecular Weight 435.286 g/mol
Solvent DMSO-D6
Source File Reference UWRU12075