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(Z)-2,5-dimethyloct-4-en-6-yn-3-yl acetate
SpectraBase Compound ID LVSfcwWxV2I
InChI InChI=1S/C12H18O2/c1-6-7-10(4)8-12(9(2)3)14-11(5)13/h8-9,12H,1-5H3/b10-8-
InChIKey LSLUXLIOUYEORV-NTMALXAHSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Za9MM5M6Z2
Name (Z)-2,5-dimethyloct-4-en-6-yn-3-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-6-7-10(4)8-12(9(2)3)14-11(5)13/h8-9,12H,1-5H3/b10-8-
InChIKey LSLUXLIOUYEORV-NTMALXAHSA-N
Literature Reference DOI 10.1021/jo200201r
Molecular Weight 194.274 g/mol
SMILES CC(=O)OC(\C=C\(C)C#CC)C(C)C
SPLASH splash10-0a4i-1900000000-36a50d5efc7dd338eb09
Source of Spectrum J-76-5966-(Z)_1.1g
Synonyms Acetic acid [(Z)-2,5-dimethyloct-4-en-6-yn-3-yl] ester [(Z)-2,5-dimethyloct-4-en-6-yn-3-yl] acetate [(Z)-1-isopropyl-3-methyl-hex-2-en-4-ynyl] acetate [(Z)-2,5-dimethyloct-4-en-6-yn-3-yl] ethanoate
Wiley ID 1746685