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2-HEPTYL-3-EXO,5-EXO-DIMETHYL-8,9,10,11-TETRAOXATRICYCLO-[5.2.1.1(2,6)]-UNDECAN-4-ONE
SpectraBase Compound ID F89ImmgCBp0
InChI InChI=1S/C16H26O5/c1-4-5-6-7-8-9-16-11(3)12(17)10(2)13(19-16)14-18-15(16)21-20-14/h10-11,13-15H,4-9H2,1-3H3/t10-,11+,13+,14+,15-,16-/m1/s1
InChIKey KDWAMQXDNQWBCU-CPRMNVSZSA-N
Mol Weight 298.38 g/mol
Molecular Formula C16H26O5
Exact Mass 298.178024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bumw5god2Cb
Name 2-HEPTYL-3-EXO,5-EXO-DIMETHYL-8,9,10,11-TETRAOXATRICYCLO-[5.2.1.1(2,6)]-UNDECAN-4-ONE
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H26O5
InChI InChI=1S/C16H26O5/c1-4-5-6-7-8-9-16-11(3)12(17)10(2)13(19-16)14-18-15(16)21-20-14/h10-11,13-15H,4-9H2,1-3H3/t10-,11+,13+,14+,15-,16-/m1/s1
InChIKey KDWAMQXDNQWBCU-CPRMNVSZSA-N
Literature Reference Author L.C.D.A.BARBOSA,D.CUTLER,J.MANN,M.J.CRABBE,G.C.KIRBY,D.C.WAR HURST
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1101(1996)
Literature Reference DOI 10.1039/p19960001101
Molecular Weight 298.379 g/mol
Solvent CDCl3
Source File Reference UWCS20608