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Syn.-Methyl 2-Allyl-3-hydroxyhexanedithioate isomer
SpectraBase Compound ID o31b0ZIsPB
InChI InChI=1S/C10H18OS2/c1-4-6-8(10(12)13-3)9(11)7-5-2/h4,8-9,11H,1,5-7H2,2-3H3/t8-,9?/m1/s1
InChIKey CKXAUWOZGBZRGR-VEDVMXKPSA-N
Mol Weight 218.37 g/mol
Molecular Formula C10H18OS2
Exact Mass 218.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3sLFGdTYVY
Name Syn.-Methyl 2-Allyl-3-hydroxyhexanedithioate isomer
Alternate Name(s) Methyl (2R)-2-[(1S)-1-hydroxybutyl]-4-pentenedithioate
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Formula C10H18OS2
InChI InChI=1S/C10H18OS2/c1-4-6-8(10(12)13-3)9(11)7-5-2/h4,8-9,11H,1,5-7H2,2-3H3/t8-,9?/m1/s1
InChIKey CKXAUWOZGBZRGR-VEDVMXKPSA-N
Molecular Weight 218.373 g/mol
SMILES OC([C@](C(=S)SC)(CC=C)[H])CCC
SPLASH splash10-00dm-9200000000-68176c4f9a5914053773
Source of Spectrum F-47-6282-34
Wiley ID 1217234