SpectraBase Spectrum ID |
HXNApkP7ZN |
Name |
3-[2-chloro-5-(trifluoromethyl)benzyl]thiophene |
Alternate Name(s) |
3-(2-Chloro-5-(trifluoromethyl)benzyl)thiophene |
Comments |
Edited after expert review for DOP contamination - Original record with SpectrumID 1749464 moved to the Legacy library |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H8ClF3S |
InChI |
InChI=1S/C12H8ClF3S/c13-11-2-1-10(12(14,15)16)6-9(11)5-8-3-4-17-7-8/h1-4,6-7H,5H2 |
InChIKey |
LGBONIKYZOUWMP-UHFFFAOYSA-N |
Molecular Weight |
276.704 g/mol |
SMILES |
c1(Cc2ccsc2)c(Cl)ccc(C(F)(F)F)c1 |
SPLASH |
splash10-0006-9150000000-61030ab04c55c5024b91 |
Source of Spectrum |
A1-16-2422/SM27-5h |
Wiley ID |
1821495 |