| SpectraBase Compound ID | JUKV2Hj6BnO |
|---|---|
| InChI | InChI=1S/C16H18O3/c1-12(17)9-10-16(14(18)7-8-15(16)19)11-13-5-3-2-4-6-13/h2-6H,7-11H2,1H3 |
| InChIKey | KUXPAJWGKQLTMB-UHFFFAOYSA-N |
| Mol Weight | 258.32 g/mol |
| Molecular Formula | C16H18O3 |
| Exact Mass | 258.125594 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IzMLaQIIwJB |
|---|---|
| Name | 2-Benzyl-2-(3-oxobutyl)cyclopentan-1,3-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H18O3 |
| InChI | InChI=1S/C16H18O3/c1-12(17)9-10-16(14(18)7-8-15(16)19)11-13-5-3-2-4-6-13/h2-6H,7-11H2,1H3 |
| InChIKey | KUXPAJWGKQLTMB-UHFFFAOYSA-N |
| Molecular Weight | 258.317 g/mol |
| SMILES | C1(C(CCC1=O)=O)(CCC(=O)C)Cc1ccccc1 |
| SPLASH | splash10-0006-9310000000-97a07e76720faa2b4bd5 |
| Source of Spectrum | J-73-5154-2c |
| Wiley ID | 1668302 |