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Bis(4-oxo-pentyl-(2',2'-dimethyl-propylene ketal)) piperidinium cation
SpectraBase Compound ID ChZKGEvQ3XI
InChI InChI=1S/C25H47NO4/c1-21(2)17-27-23(5,28-18-21)11-9-14-25(13-7-8-16-26-25)15-10-12-24(6)29-19-22(3,4)20-30-24/h26H,7-20H2,1-6H3/p+1
InChIKey GEDCDXPRXKQRFR-UHFFFAOYSA-O
Mol Weight 426.7 g/mol
Molecular Formula C25H48NO4
Exact Mass 426.358334 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID lAM4CmYgiW
Name Bis(4-oxo-pentyl-(2',2'-dimethyl-propylene ketal)) piperidinium cation
CAS Registry Number 108818-52-6
Comments OXALATE
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Formula C25H48NO4
InChI InChI=1S/C25H47NO4/c1-21(2)17-27-23(5,28-18-21)11-9-14-25(13-7-8-16-26-25)15-10-12-24(6)29-19-22(3,4)20-30-24/h26H,7-20H2,1-6H3/p+1
InChIKey GEDCDXPRXKQRFR-UHFFFAOYSA-O
Instrument Name Bruker AM-500
Literature Reference D.M. Ryckman, R.V. Stevens, J. Am. Chem. Soc. 109, 4940 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3