| SpectraBase Spectrum ID |
6jWyP3OgEH |
| Name |
2-Benzoylcyclononane-1,4-dione |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18O3 |
| InChI |
InChI=1S/C16H18O3/c17-13-9-5-2-6-10-15(18)14(11-13)16(19)12-7-3-1-4-8-12/h1,3-4,7-8,14H,2,5-6,9-11H2 |
| InChIKey |
WHOXASOUFNVMHH-UHFFFAOYSA-N |
| Instrument Name |
Simadzu GC-MS QP5050 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.13.176 |
| Molecular Weight |
258.317 g/mol |
| Reported Formula |
C16H18O3 |
| SMILES |
c1(ccccc1)C(=O)C1C(CCCCCC(C1)=O)=O |
| SPLASH |
splash10-0a4i-0910000000-03a355e91a01d3214cf6 |
| Source of Spectrum |
BJO-13-SM12-7b |
| Thin-Layer Chromatography |
Rf = 0.20 (hexane / EtOAc, 5:1) |
| Wiley ID |
1848251 |
