Perfluoro-1-butanesulfonic acid (PFBS)
Perfluoro-1-butanesulfonic acid (PFBS) Structure
Systematic / IUPAC Name: 1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulfonic acid
ID: Reference2745
Other Names:
1,1,2,2,3,3,4,4,4-Nonafluoro-1-butanesulfonic acid;
1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulphonic acid;
1-Butanesulfonic acid, 1,1,2,2,3,3,4,4,4-nonafluoro-;
1-Perfluorobutanesulfonic acid;
Butanesulfonic acid, nonafluoro-
; more
Formula: C4HF9O3S
Class: Extractables/Leachables Perfluorinated Hydrocarbons
Spectral Data
Perfluoro-1-butanesulfonic acid (PFBS) mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion; Orbitrap Fusion with FAIMS ; Q Exactive Orbitrap; Q Exactive Plus Orbitrap |
| No. of Spectral Trees | 7 |
| No. of Spectra | 974 |
| Tandem Spectra | MS1, MS2, MS3 |
| Ionization Methods | ESI; NSI |
| Analyzers | FT |
| Last Modification | 3/29/2018 7:39:10 AM |
Identificators
| InChI | InChI=1S/C4HF9O3S/c5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h(H,14,15,16) |
| InChI Key | JGTNAGYHADQMCM-UHFFFAOYSA-N |
| Canonical SMILES | C(C(C(F)(F)S(=O)(=O)O)(F)F)(C(F)(F)F)(F)F |
| CAS | 375735 |
| Splash | |
| Other Names |
1,1,2,2,3,3,4,4,4-Nonafluoro-1-butanesulfonic acid; 1,1,2,2,3,3,4,4,4-Nonafluorobutane-1-sulphonic acid; 1-Butanesulfonic acid, 1,1,2,2,3,3,4,4,4-nonafluoro-; 1-Perfluorobutanesulfonic acid; Butanesulfonic acid, nonafluoro-; Nonafluoro-1-butanesulfonic acid; Nonafluorobutane-1-sulfonic acid; Nonafluorobutanesulfonic acid; Nonafluorobutanesulphonic acid |
In Other Databases
| PubChem | 67815 |
| ChemSpider | 61132 |
| ChEMBL | CHEMBL1198521 |
| Wikipedia | Perfluorobutanesulfonic acid |
| ChemIDPlus | 000375735; 029420493 |