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HEXACYCLO-[5.4.1.0(2,6).0(3,10).0(4,8).0(9,12)]-DODECANE-5,11-DIONE
SpectraBase Compound ID 6kfzp88yo9h
InChI InChI=1S/C12H10O2/c13-11-7-1-2-4-3(1)9(11)6-5(7)8(2)12(14)10(4)6/h1-10H/t1-,2-,3-,4+,5-,6+,7-,8+,9+,10-/m0/s1
InChIKey QXTOLEPKQCKAIJ-PGSFHXNJSA-N
Mol Weight 186.21 g/mol
Molecular Formula C12H10O2
Exact Mass 186.06808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 81iZ4N8KEoJ
Name HEXACYCLO-[5.4.1.0(2,6).0(3,10).0(4,8).0(9,12)]-DODECANE-5,11-DIONE
CAS Registry Number 98230-14-9
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H10O2
InChI InChI=1S/C12H10O2/c13-11-7-1-2-4-3(1)9(11)6-5(7)8(2)12(14)10(4)6/h1-10H/t1-,2-,3-,4+,5-,6+,7-,8+,9+,10-/m0/s1
InChIKey QXTOLEPKQCKAIJ-PGSFHXNJSA-N
Literature Reference Author G.SEDELMEIER,W.D.FESSNER,R.PINKOS,C.GRUND,B.A.R.C.MURTY,D.HU NKLER,G.RIHS,H.FRITZ
Literature Reference Citation CHEM.BER.,119,3442(1986)
Literature Reference DOI 10.1002/cber.19861191121
Molecular Weight 186.210 g/mol
Solvent CDCl3
Source File Reference UWGB1429