For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-chloro-4-cyanophenyl fluorosulfate
SpectraBase Compound ID BVgrmCEb4vq
InChI InChI=1S/C7H3ClFNO3S/c8-7-3-6(13-14(9,11)12)2-1-5(7)4-10/h1-3H
InChIKey IHQFLDRTCLWYLS-UHFFFAOYSA-N
Mol Weight 235.62 g/mol
Molecular Formula C7H3ClFNO3S
Exact Mass 234.95062 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DyF8PgrYnJ7
Name 3-chloro-4-cyanophenyl fluorosulfate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3ClFNO3S
InChI InChI=1S/C7H3ClFNO3S/c8-7-3-6(13-14(9,11)12)2-1-5(7)4-10/h1-3H
InChIKey IHQFLDRTCLWYLS-UHFFFAOYSA-N
Instrument Name Agilent Technologies 5975-7820A
Ionization Type EI
Literature Reference DOI 10.1002/anie.201911465
Molecular Weight 235.616 g/mol
Reported Formula C7H3(35)ClFNO3(32)S
SMILES c1c(c(cc(c1)OS(F)(=O)=O)Cl)C#N
SPLASH splash10-0uki-1930000000-edf99150b0cade6ea8ea
Source of Spectrum ACI-59-SM8-8-4
Thin-Layer Chromatography Rf = 0.30 (10:1, pentane/Et2O)
Wiley ID 1856902