| SpectraBase Spectrum ID |
6dvWTSSmrUC |
| Name |
9-Ethyl 2-methyl-5-oxo-6,7,8,9-tetrahydro-5H-benzocycloheptene-2,9-dicarboxylate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18O5 |
| InChI |
InChI=1S/C16H18O5/c1-3-21-16(19)12-5-4-6-14(17)11-8-7-10(9-13(11)12)15(18)20-2/h7-9,12H,3-6H2,1-2H3 |
| InChIKey |
UBEQZZMCUQFZKX-UHFFFAOYSA-N |
| Instrument Name |
Thermo Scientific DFS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201905570 |
| Molecular Weight |
290.315 g/mol |
| Reported Formula |
C16H18O5 |
| SMILES |
C1CCC(c2c(C1=O)ccc(c2)C(OC)=O)C(=O)OCC |
| SPLASH |
splash10-05r0-7920000000-589984af7fb4e99da052 |
| Source of Spectrum |
QE-26-SM12-2m |
| Thin-Layer Chromatography |
Rf = 0.21 (n-pentane/Et2O, 5:1) |
| Wiley ID |
1858616 |
