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(E)-6-(ethylthio)-3,3,6-trimethyl-4-heptenoic acid methyl ester
SpectraBase Compound ID HsWKblEV5WM
InChI InChI=1S/C13H24O2S/c1-7-16-13(4,5)9-8-12(2,3)10-11(14)15-6/h8-9H,7,10H2,1-6H3/b9-8+
InChIKey AHTMGUWMOMMEHK-CMDGGOBGSA-N
Mol Weight 244.39 g/mol
Molecular Formula C13H24O2S
Exact Mass 244.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5uv3ZC8vhtm
Name (E)-6-(ethylthio)-3,3,6-trimethyl-4-heptenoic acid methyl ester
Alternate Name(s) (E)-6-(ethylthio)-3,3,6-trimethyl-hept-4-enoic acid methyl ester Methyl (E)-6-ethylsulfanyl-3,3,6-trimethyl-hept-4-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O2S
InChI InChI=1S/C13H24O2S/c1-7-16-13(4,5)9-8-12(2,3)10-11(14)15-6/h8-9H,7,10H2,1-6H3/b9-8+
InChIKey AHTMGUWMOMMEHK-CMDGGOBGSA-N
Molecular Weight 244.393 g/mol
SMILES C(\C=C\C(SCC)(C)C)(CC(=O)OC)(C)C
SPLASH splash10-0pi0-0900000000-1556cada30d73be90ddc
Source of Spectrum KC-0-60-17
Wiley ID 784813