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TRANS-2,5,6-TRICHLORO-6-METHYL-4-METHYLENECYCLOHEX-2-ENONE
SpectraBase Compound ID 427qXbGEZTe
InChI InChI=1S/C8H7Cl3O/c1-4-3-5(9)7(12)8(2,11)6(4)10/h3,6H,1H2,2H3/t6-,8+/m1/s1
InChIKey MRXPEHYKJQRNDM-SVRRBLITSA-N
Mol Weight 225.5 g/mol
Molecular Formula C8H7Cl3O
Exact Mass 223.956248 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IGAHD771gOK
Name TRANS-2,5,6-TRICHLORO-6-METHYL-4-METHYLENECYCLOHEX-2-ENONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H7Cl3O
InChI InChI=1S/C8H7Cl3O/c1-4-3-5(9)7(12)8(2,11)6(4)10/h3,6H,1H2,2H3/t6-,8+/m1/s1
InChIKey MRXPEHYKJQRNDM-SVRRBLITSA-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 225.502 g/mol
Solvent CDCl3
Source File Reference UWRK1360