| SpectraBase Spectrum ID |
535qN9XLto |
| Name |
2-Methyl-5-(2-(trifluoromethyl)aziridin-1-yl)-1H-indole |
| Appearance |
Yellow solid |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
240.087432851 u |
| Formula |
C12H11F3N2 |
| InChI |
InChI=1S/C12H11F3N2/c1-7-4-8-5-9(2-3-10(8)16-7)17-6-11(17)12(13,14)15/h2-5,11,16H,6H2,1H3 |
| InChIKey |
ONFOZXCLUBRYMM-UHFFFAOYSA-N |
| Instrument Name |
Agilent 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201802347 |
| Molecular Weight |
240.229 g/mol |
| Quality |
328 |
| Reported Formula |
C12H12F3N2 |
| SMILES |
N1C2=C(C=C1C)C=C(C=C2)N1C(C1)C(F)(F)F |
| SPLASH |
splash10-0006-0930000000-e4f9859a19be03820870 |
| Source of Spectrum |
ACI-57-SM29-3w (DOI: 10.1002/anie.201802347) |
| Thin-Layer Chromatography |
0.43 (hexanes/ethyl acetate, 3:1) |
| Wiley ID |
1891060 |
