| SpectraBase Spectrum ID |
LM4OCG4gnTO |
| Name |
Ethyl (E)-3-(4-bromophenyl)but-2-enoate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13BrO2 |
| InChI |
InChI=1S/C12H13BrO2/c1-3-15-12(14)8-9(2)10-4-6-11(13)7-5-10/h4-8H,3H2,1-2H3/b9-8+ |
| InChIKey |
MNEZJQDQBGXBGJ-CMDGGOBGSA-N |
| Instrument Name |
Finigan MAT95XP EI GC/MS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201900118 |
| Molecular Weight |
269.138 g/mol |
| Reported Formula |
C12H13O2Br |
| SMILES |
C(C)OC(\C=C/(C)c1ccc(cc1)Br)=O |
| SPLASH |
splash10-014i-0890000000-b8eb2878343d1d1e615d |
| Sample Comments |
E/Z = 99:1 |
| Source of Spectrum |
QE-25-SM38-8 |
| Thin-Layer Chromatography |
Rf = 0.59 (n-hexane/EtOAc, 20:1) |
| Wiley ID |
1848513 |
