| SpectraBase Spectrum ID |
2sfo7hoc4m |
| Name |
Methyl 4-bromo-3-iodobenzoate |
| Appearance |
Pale yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.859587431 u |
| Formula |
C8H6BrIO2 |
| InChI |
InChI=1S/C8H6BrIO2/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4H,1H3 |
| InChIKey |
FKMRYNGFIBQMMZ-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202108814 |
| Molecular Weight |
340.942 g/mol |
| Quality |
1000 |
| SMILES |
COC(C1=CC(=C(C=C1)Br)I)=O |
| SPLASH |
splash10-06r6-1119000000-73e7e3cca89400952ee1 |
| Source of Spectrum |
ACI-60-SM26-3a (DOI: 10.1002/anie.202108814) |
| Thin-Layer Chromatography |
0.75 (ethyl acetate/cyclohexane, 1:1 |
| Wiley ID |
1891332 |
