| SpectraBase Spectrum ID |
1sJlZTeLPk |
| Name |
2-(benzo[d][1,3]dioxol-5-yl)-2-(((trifluoromethyl)thio)methyl)cyclopentan-1-one |
| Appearance |
Yellow liquid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.053749939 u |
| Formula |
C14H13F3O3S |
| GC Column |
HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer) |
| GC Oven Program |
Oven temp 320oC |
| InChI |
InChI=1S/C14H13F3O3S/c15-14(16,17)21-7-13(5-1-2-12(13)18)9-3-4-10-11(6-9)20-8-19-10/h3-4,6H,1-2,5,7-8H2 |
| InChIKey |
SJBUREXBRSRQTR-UHFFFAOYSA-N |
| Instrument Name |
Agilent Technologies 7890A-5975C VL or Agilent 5975 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201600190 |
| Molecular Weight |
318.310 g/mol |
| Quality |
47 |
| Reported Formula |
C14H13O3SF3 |
| SMILES |
C1(=CC=C2C(=C1)OCO2)C1(C(CCC1)=O)CSC(F)(F)F |
| SPLASH |
splash10-0i00-0797000000-9e07649807b6efe938f0 |
| Source of Spectrum |
QE-22-SM29-7g (DOI: 10.1002/chem.201600190) |
| Thin-Layer Chromatography |
0.23 (DCM/n-pentane, 40%) |
| Wiley ID |
1903059 |
![2-(benzo[d][1,3]dioxol-5-yl)-2-(((trifluoromethyl)thio)methyl)cyclopentan-1-one](/api/spectrum/1sJlZTeLPk/structure.png?h=300&w=458 "2-(benzo[d][1,3]dioxol-5-yl)-2-(((trifluoromethyl)thio)methyl)cyclopentan-1-one")
