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N-(1-Cyano-4-hydroxybut-1-yl)-1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonamide
SpectraBase Compound ID HGLCksjbijw
InChI InChI=1S/C9H9F9N2O3S/c10-6(11,8(14,15)16)7(12,13)9(17,18)24(22,23)20-5(4-19)2-1-3-21/h5,20-21H,1-3H2
InChIKey APXVTFAOSJAFKB-UHFFFAOYSA-N
Mol Weight 396.23 g/mol
Molecular Formula C9H9F9N2O3S
Exact Mass 396.019017 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64NkvPfDInp
Name N-(1-Cyano-4-hydroxybut-1-yl)-1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonamide
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9F9N2O3S
InChI InChI=1S/C9H9F9N2O3S/c10-6(11,8(14,15)16)7(12,13)9(17,18)24(22,23)20-5(4-19)2-1-3-21/h5,20-21H,1-3H2
InChIKey APXVTFAOSJAFKB-UHFFFAOYSA-N
Instrument Name Waters GCT Premier
Ionization Type EI
Literature Reference DOI 10.1002/anie.201905209
Molecular Weight 396.228 g/mol
Reported Formula C9H8F9N2O3S
SMILES N(S(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(=O)=O)C(CCCO)C#N
SPLASH splash10-0udi-0900000000-d75383128cc18ecbe67b
Source of Spectrum ACI-58-SM11-7b
Thin-Layer Chromatography Rf = 0.39 (hexane/AcOEt, 1:1)
Wiley ID 1875446