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4,8-DICHLORO-3,7-DIMETHYLOCTA-2,4,6-TRIENAL
SpectraBase Compound ID L0t3S3UgMVE
InChI InChI=1S/C10H12Cl2O/c1-8(7-11)3-4-10(12)9(2)5-6-13/h3-6H,7H2,1-2H3/b8-3+,9-5+,10-4-
InChIKey LXFNLDHOISLYSZ-BEFBDZAPSA-N
Mol Weight 219.11 g/mol
Molecular Formula C10H12Cl2O
Exact Mass 218.02652 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 27b1DHE9inE
Name 4,8-DICHLORO-3,7-DIMETHYLOCTA-2,4,6-TRIENAL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H12Cl2O
InChI InChI=1S/C10H12Cl2O/c1-8(7-11)3-4-10(12)9(2)5-6-13/h3-6H,7H2,1-2H3/b8-3+,9-5+,10-4-
InChIKey LXFNLDHOISLYSZ-BEFBDZAPSA-N
Literature Reference Author M.G.A.MANN,H.B.MKWANANZI,E.M.ANTUNESMC.E.WHIBLEY,D.T.HENDRIC KS,J.J.BOLTON,D.R.BE
Literature Reference Citation J.NAT.PROD.,70,596(2007)
Literature Reference DOI 10.1021/np060547c
Molecular Weight 219.111 g/mol
Sample ID 30146
Solvent CDCl3