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3-Hydroxy-2-methyl-3,3-diphenyl-dithiopropanoic acid
SpectraBase Compound ID 39lQgp8kuaK
InChI InChI=1S/C16H16OS2/c1-12(15(18)19)16(17,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12,17H,1H3,(H,18,19)
InChIKey XVFDEMCMGZPBJY-UHFFFAOYSA-N
Mol Weight 288.42 g/mol
Molecular Formula C16H16OS2
Exact Mass 288.064257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KhOfsSh9Wek
Name 3-Hydroxy-2-methyl-3,3-diphenyl-dithiopropanoic acid
Alternate Name(s) 3-hydroxy-2-methyl-3,3-diphenylpropanedithioic acid
Comments Less than 3 mono-isotopic peaks
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Formula C16H16OS2
InChI InChI=1S/C16H16OS2/c1-12(15(18)19)16(17,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12,17H,1H3,(H,18,19)
InChIKey XVFDEMCMGZPBJY-UHFFFAOYSA-N
Molecular Weight 288.423 g/mol
SMILES OC(C(C(=S)S)C)(c1ccccc1)c1ccccc1
SPLASH splash10-0a59-0900000000-5d0940bc70628bea8c85
Source of Spectrum D8-326-981-12
Wiley ID 1515002