| SpectraBase Spectrum ID |
2D0MG5FwW0 |
| Name |
2-(2-Bromo-5-iodophenyl)acetonitrile |
| Appearance |
Yellowish solid |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H5BrIN |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C8H5BrIN/c9-8-2-1-7(10)5-6(8)3-4-11/h1-2,5H,3H2 |
| InChIKey |
AQDIWSKWPCISPD-UHFFFAOYSA-N |
| Inlet Type |
Split |
| Instrument Name |
Agilent Technologies 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202101279 |
| Molecular Weight |
321.943 g/mol |
| Quality |
147 |
| SMILES |
C1(Br)=C(C=C(C=C1)I)CC#N |
| SPLASH |
splash10-00di-0319000000-8cfce2dbf23fa8ac880b |
| Source of Spectrum |
K1-2022-SM8-11 (DOI: 10.1002/ejoc.202101279) |
| Thin-Layer Chromatography |
0.32 (cyclohexane/EtOAc, 20:1) |
| Wiley ID |
1898555 |
