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1,4-butanediol, bis(2,2,2-trifluoroethanesulfonate)

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1,4-butanediol, bis(2,2,2-trifluoroethanesulfonate)
SpectraBase Compound ID 5dFczsAzaPI
InChI InChI=1S/C8H12F6O6S2/c9-7(10,11)5-21(15,16)19-3-1-2-4-20-22(17,18)6-8(12,13)14/h1-6H2
InChIKey DAWNBKJYEPYYJD-UHFFFAOYSA-N
Mol Weight 382.29 g/mol
Molecular Formula C8H12F6O6S2
Exact Mass 381.997949 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E1W2mCoEnsN
Name 1,4-BUTANEDIOL, BIS(2,2,2-TRIFLUOROETHANESULFONATE)
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 117186-54-6
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12F6O6S2
InChI InChI=1S/C8H12F6O6S2/c9-7(10,11)5-21(15,16)19-3-1-2-4-20-22(17,18)6-8(12,13)14/h1-6H2
InChIKey DAWNBKJYEPYYJD-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 102C
Molecular Weight 382.30
Solvent DMSO-d6; Reference=TMS; Temperature 297K