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2-Mercaptoethanesulfonic acid, 2TMS
SpectraBase Compound ID EhBSW5GXcr4
InChI InChI=1S/C8H22O3S2Si2/c1-14(2,3)11-13(9,10)8-7-12-15(4,5)6/h7-8H2,1-6H3
InChIKey RXILVIGQVWWAEZ-UHFFFAOYSA-N
Mol Weight 286.55 g/mol
Molecular Formula C8H22O3S2Si2
Exact Mass 286.05489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7OgLlFGMjGj
Name 2-Mercaptoethanesulfonic acid, 2TMS
Comments Derivatization type: 2 TMS (mass: 286.055); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib000977; Note: The molecular formula of the structure shown is C2H6O3S2 - which differs from the formula reported for the mass spectrum (C8H22O3S2Si2)
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Formula C8H22O3S2Si2
InChI InChI=1S/C8H22O3S2Si2/c1-14(2,3)11-13(9,10)8-7-12-15(4,5)6/h7-8H2,1-6H3
InChIKey RXILVIGQVWWAEZ-UHFFFAOYSA-N
Molecular Weight 286.551 g/mol
SMILES C(CS(O[Si](C)(C)C)(=O)=O)S[Si](C)(C)C
SPLASH splash10-004m-7970000000-8172aae04cff0f843008
Source of Spectrum FM-2019-977-0
Synonyms mesna, 2TMS coenzyme M, 2TMS Mistabronco, 2TMS Uromitexan, 2TMS Mucofluid, 2TMS reduced CoM, 2TMS 2-Mercaptoethanesulfonic, 2TMS 2-sulfanylethanesulfonic acid, 2TMS Trimethylsilyl 2-((trimethylsilyl)thio)ethane-1-sulfonate
Wiley ID 1818637