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Taurine 3TMS
SpectraBase Compound ID ICZSqsHDmMQ
InChI InChI=1S/C11H31NO3SSi3/c1-17(2,3)12(18(4,5)6)10-11-16(13,14)15-19(7,8)9/h10-11H2,1-9H3
InChIKey MYBLXZCUTSINIT-UHFFFAOYSA-N
Mol Weight 341.69 g/mol
Molecular Formula C11H31NO3SSi3
Exact Mass 341.133245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FhlhAXedduZ
Name taurine, 3TMS
Comments Derivatization type: 3 TMS (mass: 341.133); CC-BY: Oliver Fiehn, University of California, Davis; MoNA-ID: FiehnLib001118; Note: The molecular formula of the structure shown is C2H7NO3S - which differs from the formula reported for the mass spectrum (C11H31NO3SSi3)
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Formula C11H31NO3SSi3
InChI InChI=1S/C11H31NO3SSi3/c1-17(2,3)12(18(4,5)6)10-11-16(13,14)15-19(7,8)9/h10-11H2,1-9H3
InChIKey MYBLXZCUTSINIT-UHFFFAOYSA-N
Molecular Weight 341.688 g/mol
SMILES C(CS(O[Si](C)(C)C)(=O)=O)N([Si](C)(C)C)[Si](C)(C)C
SPLASH splash10-0032-0901000000-76829ec2fb8b798c02d9
Source of Spectrum FM-2019-1118-0
Synonyms tauphon, 3TMS L-Taurine, 3TMS 2-Aminoethanesulfonic acid, 3TMS taufon, 3TMS Taukard, 3TMS 2-Aminoethanesulfonic acid, 3TMS Trimethylsilyl 2-(bis(trimethylsilyl)amino)ethane-1-sulfonate
Wiley ID 1818775