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ethyl 4-[2-methyl-5-(1-methyl-1-methylsulfanyl-ethyl)tetrahydrothiophen-2-yl]-4-methylsulfanyl-butanoate
SpectraBase Compound ID LUxHPsMj6Yc
InChI InChI=1S/C16H30O2S3/c1-7-18-14(17)9-8-13(19-5)16(4)11-10-12(21-16)15(2,3)20-6/h12-13H,7-11H2,1-6H3
InChIKey VMTAFZGTSRGFMF-UHFFFAOYSA-N
Mol Weight 350.59 g/mol
Molecular Formula C16H30O2S3
Exact Mass 350.140794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LApfbgMgS4K
Name ethyl 4-[2-methyl-5-(1-methyl-1-methylsulfanyl-ethyl)tetrahydrothiophen-2-yl]-4-methylsulfanyl-butanoate
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Formula C16H30O2S3
InChI InChI=1S/C16H30O2S3/c1-7-18-14(17)9-8-13(19-5)16(4)11-10-12(21-16)15(2,3)20-6/h12-13H,7-11H2,1-6H3
InChIKey VMTAFZGTSRGFMF-UHFFFAOYSA-N
Instrument Name Varian 3400
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290091522
Molecular Weight 350.594 g/mol
SMILES C1CC(SC1C(SC)(C)C)(C(CCC(=O)OCC)SC)C
SPLASH splash10-000g-7910000000-f91f8e8069befd3443e7
Source of Spectrum RCM-9-1578-Fig. 3
Wiley ID 1837364