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Acetic acid, [[(1,1-dimethylethyl)thio]thioxomethoxy]-
SpectraBase Compound ID ESibwz3ZLcD
InChI InChI=1S/C7H12O3S2/c1-7(2,3)12-6(11)10-4-5(8)9/h4H2,1-3H3,(H,8,9)
InChIKey DQMXCJQHFDXQJH-UHFFFAOYSA-N
Mol Weight 208.29 g/mol
Molecular Formula C7H12O3S2
Exact Mass 208.022787 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DjBvdW9NKKc
Name Acetic acid, [[(1,1-dimethylethyl)thio]thioxomethoxy]-
Alternate Name(s) t-Butylsulfenylthioxomethoxyethanoic acid {[(tert-butylsulfanyl)carbothioyl]oxy}acetic acid
CAS Registry Number 82979-46-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O3S2
InChI InChI=1S/C7H12O3S2/c1-7(2,3)12-6(11)10-4-5(8)9/h4H2,1-3H3,(H,8,9)
InChIKey DQMXCJQHFDXQJH-UHFFFAOYSA-N
Molecular Weight 208.290 g/mol
SMILES OC(COC(SC(C)(C)C)=S)=O
SPLASH splash10-052f-9000000000-59387e2f7438f952d126
Source of Spectrum K-118-782-3
Wiley ID 1206159