| SpectraBase Compound ID | LXGjIx9lkfL |
|---|---|
| InChI | InChI=1S/C16H22O/c1-4-5-6-7-16(14(3)17)12-15-10-8-13(2)9-11-15/h8-12H,4-7H2,1-3H3/b16-12+ |
| InChIKey | LDBUVZUCODDEPB-FOWTUZBSSA-N |
| Mol Weight | 230.35 g/mol |
| Molecular Formula | C16H22O |
| Exact Mass | 230.167065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5qkVQZaVSzR |
|---|---|
| Name | (E)-3-(4-methylbenzylidene)octan-2-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H22O |
| InChI | InChI=1S/C16H22O/c1-4-5-6-7-16(14(3)17)12-15-10-8-13(2)9-11-15/h8-12H,4-7H2,1-3H3/b16-12+ |
| InChIKey | LDBUVZUCODDEPB-FOWTUZBSSA-N |
| Ionization Type | EI |
| Molecular Weight | 230.351 g/mol |
| SMILES | CC(\C(=C\c1ccc(cc1)C)CCCCC)=O |
| SPLASH | splash10-00l6-3940000000-1f4f2377e3715bb83c4f |
| Source of Spectrum | US20100111888A1 |
| Wiley ID | 1842190 |