| SpectraBase Spectrum ID |
2ZaeneekUSb |
| Name |
3-(2-Bromo-5-iodophenyl)propanenitrile |
| Appearance |
Colorless powder |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.880657229 u |
| Formula |
C9H7BrIN |
| GC Oven Program |
Oven temp 300oC |
| InChI |
InChI=1S/C9H7BrIN/c10-9-4-3-8(11)6-7(9)2-1-5-12/h3-4,6H,1-2H2 |
| InChIKey |
HBNMARQLDABQJL-UHFFFAOYSA-N |
| Inlet Type |
Split |
| Instrument Name |
Agilent Technologies 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202101279 |
| Molecular Weight |
335.970 g/mol |
| SMILES |
C1(Br)=C(C=C(C=C1)I)CCC#N |
| SPLASH |
splash10-000b-0096000000-a90f93719ba7cd077be6 |
| Source of Spectrum |
K1-2022-SM18-23 (DOI: 10.1002/ejoc.202101279) |
| Thin-Layer Chromatography |
0.09 (cyclohexane/EtOAc, 20:1) |
| Wiley ID |
1898561 |
