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

*Links on SpectraBase are not permalinks.
3-Nitrobenzenesulfonic acid difluoromethyl ester
SpectraBase Compound ID FKHjgdkLEMc
InChI InChI=1S/C7H5F2NO5S/c8-7(9)15-16(13,14)6-3-1-2-5(4-6)10(11)12/h1-4,7H
InChIKey YTWJPPZZYMLXTG-UHFFFAOYSA-N
Mol Weight 253.18 g/mol
Molecular Formula C7H5F2NO5S
Exact Mass 252.98565 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 GJ5a2JiystG
Name 3-Nitrobenzenesulfonic acid difluoromethyl ester
CAS Registry Number 120608-91-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5F2NO5S
InChI InChI=1S/C7H5F2NO5S/c8-7(9)15-16(13,14)6-3-1-2-5(4-6)10(11)12/h1-4,7H
InChIKey YTWJPPZZYMLXTG-UHFFFAOYSA-N
Molecular Weight 253.176 g/mol
SMILES C(OS(c1cc(N(=O)=O)ccc1)(=O)=O)(F)F
SPLASH splash10-0udr-3890000000-b85a97ba116243e2b96e
Source of Spectrum J-54-3027-9
Synonyms bis(fluoranyl)methyl 3-nitrobenzenesulfonate difluoromethyl 3-nitrobenzenesulfonate
Wiley ID 1256495