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2H-Pyran-2,4-diol, tetrahydro-6,6-bis(trifluoromethyl)-, 2-methanesulfonate, trans-(.+-.)-
SpectraBase Compound ID 2vvx5XLbn0j
InChI InChI=1S/C8H10F6O5S/c1-20(16,17)19-5-2-4(15)3-6(18-5,7(9,10)11)8(12,13)14/h4-5,15H,2-3H2,1H3/t4-,5-/m0/s1
InChIKey ZKEDUJKAHSKHDA-WHFBIAKZSA-N
Mol Weight 332.21 g/mol
Molecular Formula C8H10F6O5S
Exact Mass 332.015314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cb3M23KpVsE
Name 2H-Pyran-2,4-diol, tetrahydro-6,6-bis(trifluoromethyl)-, 2-methanesulfonate, trans-(.+-.)-
Alternate Name(s) (2S,4R)-4-hydroxy-6,6-bis(trifluoromethyl)tetrahydro-2H-pyran-2-yl methanesulfonate (2SR,4RS)-2-methylsulphonyloxy-6,6-bis(tri-fluoromethyl)tetrahydropyran-4-ol
CAS Registry Number 130184-64-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10F6O5S
InChI InChI=1S/C8H10F6O5S/c1-20(16,17)19-5-2-4(15)3-6(18-5,7(9,10)11)8(12,13)14/h4-5,15H,2-3H2,1H3/t4-,5-/m0/s1
InChIKey ZKEDUJKAHSKHDA-WHFBIAKZSA-N
Molecular Weight 332.213 g/mol
SMILES O[C@]1(C[C@@](OC(C(F)(F)F)(C(F)(F)F)C1)(OS(=O)(=O)C)[H])[H]
SPLASH splash10-014i-6090000000-ad76832a751bcedcc8da
Source of Spectrum KC-1990-624-29
Wiley ID 1328955