SpectraBase Spectrum ID |
2e6eHmc4tde |
Name |
S-(Trifluoromethyl) 4-chlorobenzothioate |
Appearance |
Yellow solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
239.962348111 u |
Formula |
C8H4ClF3OS |
InChI |
InChI=1S/C8H4ClF3OS/c9-6-3-1-5(2-4-6)7(13)14-8(10,11)12/h1-4H |
InChIKey |
GYDGLKMEGPOALV-UHFFFAOYSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.202104395 |
Molecular Weight |
240.627 g/mol |
Quality |
71 |
Reported Formula |
C8H4ClF3OS |
SMILES |
C(SC(F)(F)F)(C1=CC=C(C=C1)Cl)=O |
SPLASH |
splash10-01p9-0900000000-a2667fa0cdbddbd6f88b |
Source of Spectrum |
QE-28-SM4-2b (DOI: 10.1002/chem.202104395) |
Wiley ID |
1898312 |