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3-Hydroxy-2-methyl-3-phenyl-dithiopropanoic acid
SpectraBase Compound ID 27SDkkdo4a9
InChI InChI=1S/C10H12OS2/c1-7(10(12)13)9(11)8-5-3-2-4-6-8/h2-7,9,11H,1H3,(H,12,13)
InChIKey IANHYPNZFMQCTI-UHFFFAOYSA-N
Mol Weight 212.32 g/mol
Molecular Formula C10H12OS2
Exact Mass 212.032957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 797tdYNYF8s
Name 3-Hydroxy-2-methyl-3-phenyl-dithiopropanoic acid
Alternate Name(s) 3-hydroxy-2-methyl-3-phenylpropanedithioic acid
Comments Less than 3 mono-isotopic peaks
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Formula C10H12OS2
InChI InChI=1S/C10H12OS2/c1-7(10(12)13)9(11)8-5-3-2-4-6-8/h2-7,9,11H,1H3,(H,12,13)
InChIKey IANHYPNZFMQCTI-UHFFFAOYSA-N
Molecular Weight 212.325 g/mol
SMILES SC(C(C(c1ccccc1)O)C)=S
SPLASH splash10-0a4i-0900000000-eafaafc80b4c6c9cafc5
Source of Spectrum D8-326-981-12
Wiley ID 1515005