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(-)-(1S,2R,3S)-[3-DIPHENYLPHOSPHANYL-6,6-DIMETHYLBICYCLO-[3.1.1]-HEPTANE-2-YL]-METHANAMINIUM-4-METHYLBENZENESULFONATE
SpectraBase Compound ID FAqgeGNIlfr
InChI InChI=1S/C22H28NP.C7H8O3S/c1-22(2)16-13-20(22)19(15-23)21(14-16)24(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-6-2-4-7(5-3-6)11(8,9)10/h3-12,16,19-21H,13-15,23H2,1-2H3;2-5H,1H3,(H,8,9,10)/t16-,19+,20+,21+;/m1./s1
InChIKey ZSYUKGJKSRCLSX-NOMQNGFFSA-N
Mol Weight 509.64 g/mol
Molecular Formula C29H36NO3PS
Exact Mass 509.215352 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Wa80GyVxXK
Name (-)-(1S,2R,3S)-[3-DIPHENYLPHOSPHANYL-6,6-DIMETHYLBICYCLO-[3.1.1]-HEPTANE-2-YL]-METHANAMINIUM-4-METHYLBENZENESULFONATE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H36NO3PS
InChI InChI=1S/C22H28NP.C7H8O3S/c1-22(2)16-13-20(22)19(15-23)21(14-16)24(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-6-2-4-7(5-3-6)11(8,9)10/h3-12,16,19-21H,13-15,23H2,1-2H3;2-5H,1H3,(H,8,9,10)/t16-,19+,20+,21+;/m1./s1
InChIKey ZSYUKGJKSRCLSX-NOMQNGFFSA-N
Literature Reference Author B.WIESE,G.KNUEHL,D.FLUBACHER,J.W.PRIESS,B.ULRIKSEN,K.BROEDNE R,G.HELMCHEN
Literature Reference Citation EUR.J.ORG.CHEM.,3246(2005)
Molecular Weight 509.644 g/mol
Sample ID 29926
Solvent CDCl3