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TRANS-2,5,6-TRICHLORO-3,6-DIMETHYL-4-METHYLENECYCLOHEX-2-ENONE
SpectraBase Compound ID BYadubOY8vs
InChI InChI=1S/C9H9Cl3O/c1-4-5(2)7(11)9(3,12)8(13)6(4)10/h7H,2H2,1,3H3/t7-,9+/m0/s1
InChIKey ZFEWBLXEHCZXOO-IONNQARKSA-N
Mol Weight 239.53 g/mol
Molecular Formula C9H9Cl3O
Exact Mass 237.971898 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DzCDHnZ5L8T
Name TRANS-2,5,6-TRICHLORO-3,6-DIMETHYL-4-METHYLENECYCLOHEX-2-ENONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9Cl3O
InChI InChI=1S/C9H9Cl3O/c1-4-5(2)7(11)9(3,12)8(13)6(4)10/h7H,2H2,1,3H3/t7-,9+/m0/s1
InChIKey ZFEWBLXEHCZXOO-IONNQARKSA-N
Literature Reference Author J.L.M.GORDON,M.P.HARTSHORN,R.J.MARTYN,A.J.MORGAN,W.T.ROBINSO N,G.J.WRIGHT
Literature Reference Citation AUSTR.J.CHEM.,47,289(1994)
Literature Reference DOI 10.1071/ch9940289
Molecular Weight 239.529 g/mol
Solvent CDCl3
Source File Reference UWRK1358