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5-OXANONACYCLO-[9.8.1.1(1,17).0(3,18).0(4,6).0(4,).0(6,17).0(8,12).0(15,19)]-HENICOSANE-14,20-DIONE
SpectraBase Compound ID 2PSVaNRFyqz
InChI InChI=1S/C20H20O3/c21-17-5-1-9-15-10-2-6(13(5)15)18(22)8-4-12-16-11(3-7(17)14(8)16)19(9)20(10,12)23-19/h5-16H,1-4H2/t5-,6+,7+,8-,9+,10-,11-,12+,13+,14-,15-,16+,19+,20-
InChIKey CCXSEHADTMPHQP-RNGRVKIKSA-N
Mol Weight 308.38 g/mol
Molecular Formula C20H20O3
Exact Mass 308.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ILioEVJTozy
Name 5-OXANONACYCLO-[9.8.1.1(1,17).0(3,18).0(4,6).0(4,).0(6,17).0(8,12).0(15,19)]-HENICOSANE-14,20-DIONE
CAS Registry Number 118761-03-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20O3
InChI InChI=1S/C20H20O3/c21-17-5-1-9-15-10-2-6(13(5)15)18(22)8-4-12-16-11(3-7(17)14(8)16)19(9)20(10,12)23-19/h5-16H,1-4H2/t5-,6+,7+,8-,9+,10-,11-,12+,13+,14-,15-,16+,19+,20-
InChIKey CCXSEHADTMPHQP-RNGRVKIKSA-N
Literature Reference Author B.A.R.C.MURTY,R.PINKOS,P.R.SPURR,W.D.FESSNER,G.LUTZ,H.FRITZ, D.HUNKLER,H.PRINZBAC
Literature Reference Citation CHEM.BER.,125,1719(1992)
Literature Reference DOI 10.1002/cber.19921250728
Molecular Weight 308.377 g/mol
Solvent CDCl3
Source File Reference UWCS8433