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1-Tosyl-(5E,7Z)-undeca-5,7-diene
SpectraBase Compound ID LuAqMfMVbmc
InChI InChI=1S/C18H26O3S/c1-3-4-5-6-7-8-9-10-11-16-21-22(19,20)18-14-12-17(2)13-15-18/h5-8,12-15H,3-4,9-11,16H2,1-2H3/b6-5-,8-7+
InChIKey OKSXXUGQKKOLRI-IGTJQSIKSA-N
Mol Weight 322.46 g/mol
Molecular Formula C18H26O3S
Exact Mass 322.160266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID gWbw6236Us
Name 1-Tosyl-(5E,7Z)-undeca-5,7-diene
Comments Less than 3 mono-isotopic peaks
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Formula C18H26O3S
InChI InChI=1S/C18H26O3S/c1-3-4-5-6-7-8-9-10-11-16-21-22(19,20)18-14-12-17(2)13-15-18/h5-8,12-15H,3-4,9-11,16H2,1-2H3/b6-5-,8-7+
InChIKey OKSXXUGQKKOLRI-IGTJQSIKSA-N
Molecular Weight 322.463 g/mol
SMILES c1(S(=O)(=O)OCCCC\C=C\C=C/CCC)ccc(C)cc1
SPLASH splash10-0udi-0902000000-14deb09cab76134f22b6
Source of Spectrum F-65-1075-13
Wiley ID 1712682