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(7Z)-1-(Acetoxy)-8-chloro-7-(dichloromethyl)-3-methyloct-7-en-4-one
SpectraBase Compound ID LPTfzJYRc9O
InChI InChI=1S/C12H17Cl3O3/c1-8(5-6-18-9(2)16)11(17)4-3-10(7-13)12(14)15/h7-8,12H,3-6H2,1-2H3/b10-7-
InChIKey GSIKKOJPSUFPTR-YFHOEESVSA-N
Mol Weight 315.62 g/mol
Molecular Formula C12H17Cl3O3
Exact Mass 314.024328 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A60emNaInkS
Name (7Z)-1-ACETOXY-8-CHLORO-7-(DICHLOROMETHYL)-3-METHYLOCT-7-EN-4-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17Cl3O3
InChI InChI=1S/C12H17Cl3O3/c1-8(5-6-18-9(2)16)11(17)4-3-10(7-13)12(14)15/h7-8,12H,3-6H2,1-2H3/b10-7-
InChIKey GSIKKOJPSUFPTR-YFHOEESVSA-N
Literature Reference Author M.J.ORTEGA,E.ZUBIA,J.SALVA
Literature Reference Citation J.NAT.PROD.,60,482(1997)
Literature Reference DOI 10.1021/np960744j
Molecular Weight 315.624 g/mol
Solvent CDCl3
Source File Reference UWKP211