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(4E,6E)-4,6-Octadien-2-yl methanesulfonate
SpectraBase Compound ID ATPRWiKLkiJ
InChI InChI=1S/C9H16O3S/c1-4-5-6-7-8-9(2)12-13(3,10)11/h4-7,9H,8H2,1-3H3/b5-4+,7-6+
InChIKey VGAAHIMCNUKRKD-YTXTXJHMSA-N
Mol Weight 204.28 g/mol
Molecular Formula C9H16O3S
Exact Mass 204.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRy4DqQMKlf
Name (4E,6E)-4,6-Octadien-2-yl methanesulfonate
Alternate Name(s) (3E,5E)-1-methyl-3,5-heptadienyl methanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3S
InChI InChI=1S/C9H16O3S/c1-4-5-6-7-8-9(2)12-13(3,10)11/h4-7,9H,8H2,1-3H3/b5-4+,7-6+
InChIKey VGAAHIMCNUKRKD-YTXTXJHMSA-N
Molecular Weight 204.284 g/mol
SMILES CS(=O)(=O)OC(C)C\C=C\C=C\C
SPLASH splash10-055f-9200000000-c80d04094da93bbca78d
Source of Spectrum F-56-876-0
Wiley ID 855775