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1,1,1,3,3,3-hexafluoroisopropyl phenylmethanesulfonate
SpectraBase Compound ID 2to2IQgOMaT
InChI InChI=1S/C10H8F6O3S/c11-9(12,13)8(10(14,15)16)19-20(17,18)6-7-4-2-1-3-5-7/h1-5,8H,6H2
InChIKey RZKGGRLCNYFXMV-UHFFFAOYSA-N
Mol Weight 322.22 g/mol
Molecular Formula C10H8F6O3S
Exact Mass 322.009834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID SuXyWkuo87
Name 1,1,1,3,3,3-hexafluoroisopropyl phenylmethanesulfonate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.009834267 u
Formula C10H8F6O3S
InChI InChI=1S/C10H8F6O3S/c11-9(12,13)8(10(14,15)16)19-20(17,18)6-7-4-2-1-3-5-7/h1-5,8H,6H2
InChIKey RZKGGRLCNYFXMV-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201701766
Molecular Weight 322.221 g/mol
Quality 131
SMILES C(OS(=O)(=O)CC1=CC=CC=C1)(C(F)(F)F)C(F)(F)F
SPLASH splash10-0006-9001000000-2d418d9d4a1f78930978
Source of Spectrum K1-2018-SM15-4c (DOI: 10.1002/ejoc.201701766)
Wiley ID 1894025