| SpectraBase Spectrum ID |
6H46JOJRZyL |
| Name |
tert-Butyl 7-oxocyclohepta-1,3,5-triene-1-carboxylate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14O3 |
| InChI |
InChI=1S/C12H14O3/c1-12(2,3)15-11(14)9-7-5-4-6-8-10(9)13/h4-8H,1-3H3 |
| InChIKey |
PHWYGUHYJKSRNO-UHFFFAOYSA-N |
| Instrument Name |
HP6890-5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.10.188 |
| Molecular Weight |
206.241 g/mol |
| Reported Formula |
C12H14O3 |
| SMILES |
C1=CC=CC=C(C1=O)C(=O)OC(C)(C)C |
| SPLASH |
splash10-0pe9-8900000000-574f0d76439a01789b35 |
| Source of Spectrum |
BJO-10-SM6-12a |
| Thin-Layer Chromatography |
Rf = 0.28 (hexane/ethyl acetate, 2:1) |
| Wiley ID |
1853961 |
