| SpectraBase Spectrum ID |
KosikmMhZ9y |
| Name |
4,4,4-Trifluoro-3-(4-(methylthio)phenyl)butanenitrile |
| Appearance |
Brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H10F3NS |
| InChI |
InChI=1S/C11H10F3NS/c1-16-9-4-2-8(3-5-9)10(6-7-15)11(12,13)14/h2-5,10H,6H2,1H3 |
| InChIKey |
ATKFRFYOTQYAAG-UHFFFAOYSA-N |
| Instrument Name |
HRMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.orglett.1c01988 |
| Molecular Weight |
245.263 g/mol |
| Reported Formula |
C11H10F3NS |
| SMILES |
c1c(ccc(C(CC#N)C(F)(F)F)c1)SC |
| SPLASH |
splash10-0a4i-0190000000-e3e2799f037266de1a11 |
| Source of Spectrum |
A1-23-SM53-2o |
| Wiley ID |
1870243 |
