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

*Links on SpectraBase are not permalinks.

1-Dodecanesulfonic acid, difluoromethyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-Dodecanesulfonic acid, difluoromethyl ester
SpectraBase Compound ID ZK3CXxFsH8
InChI InChI=1S/C13H26F2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-19(16,17)18-13(14)15/h13H,2-12H2,1H3
InChIKey BMMNBBLYUNTSTO-UHFFFAOYSA-N
Mol Weight 300.4 g/mol
Molecular Formula C13H26F2O3S
Exact Mass 300.157072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID BWrG2f2jiWO
Name 1-Dodecanesulfonic acid, difluoromethyl ester
CAS Registry Number 120608-94-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H26F2O3S
InChI InChI=1S/C13H26F2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-19(16,17)18-13(14)15/h13H,2-12H2,1H3
InChIKey BMMNBBLYUNTSTO-UHFFFAOYSA-N
Molecular Weight 300.405 g/mol
SMILES C(OS(=O)(=O)CCCCCCCCCCCC)(F)F
SPLASH splash10-014i-0930000000-280af07b7b2e83d00bc0
Source of Spectrum J-54-3027-9
Synonyms difluoromethyl 1-dodecanesulfonate
Wiley ID 1302492