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4,8-Dimethyl-3(E),7-nonadienyl Thioacetate
SpectraBase Compound ID Evo06FWhybu
InChI InChI=1S/C13H22OS/c1-11(2)7-5-8-12(3)9-6-10-14-13(4)15/h7,9H,5-6,8,10H2,1-4H3/b12-9+
InChIKey GXWPMNRDPTXFHH-FMIVXFBMSA-N
Mol Weight 226.38 g/mol
Molecular Formula C13H22OS
Exact Mass 226.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ERkx9TvF9rS
Name 4,8-Dimethyl-3(E),7-nonadienyl Thioacetate
Alternate Name(s) O-[(3E)-4,8-dimethyl-3,7-nonadienyl]ethanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22OS
InChI InChI=1S/C13H22OS/c1-11(2)7-5-8-12(3)9-6-10-14-13(4)15/h7,9H,5-6,8,10H2,1-4H3/b12-9+
InChIKey GXWPMNRDPTXFHH-FMIVXFBMSA-N
Molecular Weight 226.378 g/mol
SMILES C(=S)(OCC\C=C\(CCC=C(C)C)C)C
SPLASH splash10-015c-9000000000-10b752e523c346d042a5
Source of Spectrum J-56-3860-21
Wiley ID 1227528