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(3Z,5E)-1-ACETOXY-4-CHLORO-3,7-DIMETHYLOCTA-3,5,7-TRIENE
SpectraBase Compound ID F6fQTg34nRt
InChI InChI=1S/C12H17ClO2/c1-9(2)5-6-12(13)10(3)7-8-15-11(4)14/h5-6H,1,7-8H2,2-4H3/b6-5+,12-10-
InChIKey XLZRCUYYZGIJTQ-NARAHQAKSA-N
Mol Weight 228.72 g/mol
Molecular Formula C12H17ClO2
Exact Mass 228.091707 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G5C7gSVZqzg
Name (3Z,5E)-1-ACETOXY-4-CHLORO-3,7-DIMETHYLOCTA-3,5,7-TRIENE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H17ClO2
InChI InChI=1S/C12H17ClO2/c1-9(2)5-6-12(13)10(3)7-8-15-11(4)14/h5-6H,1,7-8H2,2-4H3/b6-5+,12-10-
InChIKey XLZRCUYYZGIJTQ-NARAHQAKSA-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 228.719 g/mol
Solvent C6D6
Source File Reference UWKP209