| SpectraBase Spectrum ID |
H92rS1Tm71x |
| Name |
1-(4-Iodophenyl)-2-(trifluoromethyl)aziridine |
| Appearance |
Colorless oil |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
312.957528718 u |
| Formula |
C9H7F3IN |
| InChI |
InChI=1S/C9H7F3IN/c10-9(11,12)8-5-14(8)7-3-1-6(13)2-4-7/h1-4,8H,5H2 |
| InChIKey |
BVPFOEAALSCYOB-UHFFFAOYSA-N |
| Instrument Name |
Agilent 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201802347 |
| Molecular Weight |
313.062 g/mol |
| Quality |
512 |
| Reported Formula |
C9H8F3IN |
| SMILES |
C1(=CC=C(C=C1)I)N1C(C1)C(F)(F)F |
| SPLASH |
splash10-02vl-9331000000-4fa98fc0b18849a15961 |
| Source of Spectrum |
ACI-57-SM25-3p (DOI: 10.1002/anie.201802347) |
| Thin-Layer Chromatography |
0.23 (hexanes/ethyl acetate, 10:1) |
| Wiley ID |
1891053 |
