| SpectraBase Spectrum ID |
4l7bKrJAtFF |
| Name |
Ethyl 3-bromo-9-oxo-6,7,8,9-tetrahydro-5H-benzocycloheptene-5-carboxylate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H15BrO3 |
| InChI |
InChI=1S/C14H15BrO3/c1-2-18-14(17)11-4-3-5-13(16)10-7-6-9(15)8-12(10)11/h6-8,11H,2-5H2,1H3 |
| InChIKey |
OEWJDGQZBHJBPT-UHFFFAOYSA-N |
| Instrument Name |
Thermo Scientific DFS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201905570 |
| Molecular Weight |
311.175 g/mol |
| Reported Formula |
C14H15BrO3 |
| SMILES |
C1CCC(c2c(C1=O)ccc(c2)Br)C(OCC)=O |
| SPLASH |
splash10-0gwr-0971000000-032a35500f9cb74c9ace |
| Source of Spectrum |
QE-26-SM10-2k |
| Thin-Layer Chromatography |
Rf = 0.17 (n-pentane/Et2O, 10:1) |
| Wiley ID |
1858614 |
