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ISO-6-CASSINE;2-DODECANONE,12-[(2S,3R,6S)-3-HYDROXY-2-METHYL-2-PIPERIDINYL]
SpectraBase Compound ID JVvAI8U30qS
InChI InChI=1S/C18H35NO2/c1-15(20)11-9-7-5-3-4-6-8-10-12-17-13-14-18(21)16(2)19-17/h16-19,21H,3-14H2,1-2H3/t16-,17-,18-/m1/s1
InChIKey QPRMGHKASRLPJP-KZNAEPCWSA-N
Mol Weight 297.5 g/mol
Molecular Formula C18H35NO2
Exact Mass 297.266779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JwetbkIzWFd
Name ISO-6-CASSINE;2-DODECANONE,12-[(2S,3R,6S)-3-HYDROXY-2-METHYL-2-PIPERIDINYL]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H35NO2
InChI InChI=1S/C18H35NO2/c1-15(20)11-9-7-5-3-4-6-8-10-12-17-13-14-18(21)16(2)19-17/h16-19,21H,3-14H2,1-2H3/t16-,17-,18-/m1/s1
InChIKey QPRMGHKASRLPJP-KZNAEPCWSA-N
Literature Reference Author F.D.O.SILVA,M.G.D.V.SILVA,D.FENG,R.M.DEFREITAS
Literature Reference Citation FITOTERAPIA,82,255(2011)
Literature Reference DOI 10.1016/j.fitote.2010.10.007
Molecular Weight 297.481 g/mol
Solvent CD3OD
Source File Reference UWDB1199