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Methanesulfonic acid, trifluoro-, 1,4-butanediyl-2,2,3,3-d4 ester
SpectraBase Compound ID IQ5LRSgAJMU
InChI InChI=1S/C6H8F6O6S2/c7-5(8,9)19(13,14)17-3-1-2-4-18-20(15,16)6(10,11)12/h1-4H2/i1D2,2D2
InChIKey DMELKSCHWNDMLR-LNLMKGTHSA-N
Mol Weight 358.26 g/mol
Molecular Formula C6H42D4F6O6S2
Exact Mass 357.991756 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1zmeLmrG5N
Name Methanesulfonic acid, trifluoro-, 1,4-butanediyl-2,2,3,3-d4 ester
CAS Registry Number 100093-86-5
Comments Less than 3 mono-isotopic peaks
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Formula C6H4D4F6O6S2
InChI InChI=1S/C6H8F6O6S2/c7-5(8,9)19(13,14)17-3-1-2-4-18-20(15,16)6(10,11)12/h1-4H2/i1D2,2D2
InChIKey DMELKSCHWNDMLR-LNLMKGTHSA-N
Molecular Weight 358.259 g/mol
SMILES C(S(=O)(=O)OCC(C(COS(C(F)(F)F)(=O)=O)([2D])[2D])([2D])[2D])(F)(F)F
SPLASH splash10-014i-9100000000-d9283e7e51817bee5326
Source of Spectrum K-118-4294-4
Synonyms 2,2,3,3-Tetradeuteriobutan-1,4-diyl-bis(trifluormethansulfonat)
Wiley ID 1344164