| SpectraBase Spectrum ID |
8KaNaSQOEoD |
| Name |
BAY 59-3074 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H13F6NO4S |
| InChI |
InChI=1S/C18H13F6NO4S/c19-17(20,21)8-3-9-30(26,27)29-13-5-1-4-12(10-13)28-16-7-2-6-15(14(16)11-25)18(22,23)24/h1-2,4-7,10H,3,8-9H2 |
| InChIKey |
LWUSZIVDPJPVBW-UHFFFAOYSA-N |
| Molecular Weight |
453.355 g/mol |
| SMILES |
c1(c(c(ccc1)Oc1cccc(c1)OS(=O)(=O)CCCC(F)(F)F)C#N)C(F)(F)F |
| SPLASH |
splash10-0fb9-4190300000-4d5de75ba8cf21f6d5c9 |
| Source of Spectrum |
SWG-33-1202-0 |
| Synonyms |
3-[2-Cyano-3-(trifluoromethyl)phenoxy]phenyl 4,4,4-trifluoro-1-butanesulfonic acid ester
3-(2-cyano-3-(trifluoromethyl)phenoxy)phenyl 4,4,4-trifluorobutane-1-sulfonate |
| Wiley ID |
1809068 |
