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PXXAUQKLTLADAU-QTFMQBAUSA-N

View entire compound with spectra: 2 NMR, and 1 MS (GC)

PXXAUQKLTLADAU-QTFMQBAUSA-N
SpectraBase Compound ID HQBSbBnbJJB
InChI InChI=1S/C15H22O2/c1-9-6-7-11-12-10(14(16)17-3)5-4-8-15(11,2)13(9)12/h6,10-13H,4-5,7-8H2,1-3H3/t10?,11-,12-,13+,15+/m1/s1
InChIKey PXXAUQKLTLADAU-QTFMQBAUSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Kh4cHswqGx
Name PXXAUQKLTLADAU-QTFMQBAUSA-N
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-9-6-7-11-12-10(14(16)17-3)5-4-8-15(11,2)13(9)12/h6,10-13H,4-5,7-8H2,1-3H3/t10?,11-,12-,13+,15+/m1/s1
InChIKey PXXAUQKLTLADAU-QTFMQBAUSA-N
Literature Reference Author A.F.BARRERO,M.M.HERRADOR,J.M.MOLINA,J.F.QUILEZ,M.QUIROS
Literature Reference Citation J.NAT.PROD.,57,873(1994)
Literature Reference DOI 10.1021/np50109a001
Molecular Weight 234.338 g/mol
Solvent CDCl3
Source File Reference UWTS2256