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Hexacyclo(5.4.1.0/2,6/.0/3,10/.0/5,9/.0/8,11/)dodecane-4,12-dione
SpectraBase Compound ID 6avR1f1ZVoF
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?/m1/s1
InChIKey QXTOLEPKQCKAIJ-RQMMXTIESA-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 8rhJZ0BTdMW
Name Hexacyclo(5.4.1.0/2,6/.0/3,10/.0/5,9/.0/8,11/)dodecane-4,12-dione
CAS Registry Number 98230-14-9
Comments CHEMICAL BOND BETWEEN C2 AND C6 NOT REPRESENTABLE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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?/m1/s1
InChIKey QXTOLEPKQCKAIJ-RQMMXTIESA-N
Literature Reference G. Mehta, M.S. Nair, J. Am. Chem. Soc. 107, 7519 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3