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mercaptoacetic acid, dithiobenzoate

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mercaptoacetic acid, dithiobenzoate
SpectraBase Compound ID HADWmgIHkae
InChI InChI=1S/C9H8O2S2/c10-8(11)6-13-9(12)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,11)
InChIKey XBEIANFIOZTEDE-UHFFFAOYSA-N
Mol Weight 212.28 g/mol
Molecular Formula C9H8O2S2
Exact Mass 211.996572 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Fz1XNIfJwe
Name DITHIOBENZOIC ACID, ESTER WITH MERCAPTOACETIC ACID
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8O2S2
InChI InChI=1S/C9H8O2S2/c10-8(11)6-13-9(12)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,11)
InChIKey XBEIANFIOZTEDE-UHFFFAOYSA-N
Melting Point 127-128C
Molecular Weight 212.29
Solvent Polysol; Reference=Dioxane Spectrometer= Varian HA-100/Digilab FT-NMR-3
Synonyms BENZOIC ACID, DITHIO-, ESTER WITH MERCAPTOACETIC ACID ACETIC ACID, MERCAPTO-, ESTER WITH DITHIOBENZOIC ACID