| SpectraBase Spectrum ID |
1j9fIzVgCqH |
| Name |
tert-Butyl 3,4-dichloro-2-methoxy-7-oxocyclohepta-1,3-diene-1-carboxylate |
| Appearance |
Orange oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16Cl2O4 |
| InChI |
InChI=1S/C13H16Cl2O4/c1-13(2,3)19-12(17)9-8(16)6-5-7(14)10(15)11(9)18-4/h5-6H2,1-4H3 |
| InChIKey |
BRTTYNXKGZFSNE-UHFFFAOYSA-N |
| Instrument Name |
HP6890-5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.10.188 |
| Molecular Weight |
307.173 g/mol |
| Reported Formula |
C13H16Cl2O4 |
| SMILES |
C1CC(=C(C(=C(C1=O)C(=O)OC(C)(C)C)OC)Cl)Cl |
| SPLASH |
splash10-05gi-3930000000-4989c86779bb14cdaa4a |
| Source of Spectrum |
BJO-10-SM13-22 |
| Thin-Layer Chromatography |
Rf = 0.16 (hexane/ethyl acetate, 5:1) |
| Wiley ID |
1853969 |
