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ISOSOPHORANONE
SpectraBase Compound ID HnofEsTJhJP
InChI InChI=1S/C26H30O6/c1-14(2)6-8-17-21(28)12-22-23(24(17)29)25(30)19(13-32-22)16-10-11-20(27)18(26(16)31-5)9-7-15(3)4/h6-7,10-12,19,27-29H,8-9,13H2,1-5H3/t19-/m0/s1
InChIKey ARNVYCOTFWJTBS-IBGZPJMESA-N
Mol Weight 438.52 g/mol
Molecular Formula C26H30O6
Exact Mass 438.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ejr7V1o9ini
Name ISOSOPHORANONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H30O6
InChI InChI=1S/C26H30O6/c1-14(2)6-8-17-21(28)12-22-23(24(17)29)25(30)19(13-32-22)16-10-11-20(27)18(26(16)31-5)9-7-15(3)4/h6-7,10-12,19,27-29H,8-9,13H2,1-5H3/t19-/m0/s1
InChIKey ARNVYCOTFWJTBS-IBGZPJMESA-N
Literature Reference Author G.B.RUSSELL
Literature Reference Citation AUSTR.J.CHEM.,50,333(1997)
Literature Reference DOI 10.1071/C96109
Molecular Weight 438.521 g/mol
Solvent CDCl3
Source File Reference UWCS15750