| SpectraBase Compound ID | IAYczZclJh9 |
|---|---|
| InChI | InChI=1S/C7H10O2/c1-3-7(9)5-4-6(2)8/h3H,1,4-5H2,2H3 |
| InChIKey | FSNYLYRQGAASLZ-UHFFFAOYSA-N |
| Mol Weight | 126.15 g/mol |
| Molecular Formula | C7H10O2 |
| Exact Mass | 126.06808 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DlkCxfaa31H |
|---|---|
| Name | 3,6-Diketohept-1-ene |
| Alternate Name(s) | 6-Heptene-2,5-dione Hept-6-ene-2,5-dione |
| CAS Registry Number | 70353-50-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H10O2 |
| InChI | InChI=1S/C7H10O2/c1-3-7(9)5-4-6(2)8/h3H,1,4-5H2,2H3 |
| InChIKey | FSNYLYRQGAASLZ-UHFFFAOYSA-N |
| Molecular Weight | 126.155 g/mol |
| SMILES | CC(=O)CCC(=O)C=C |
| SPLASH | splash10-054o-9000000000-fd5ea1fad6fb11707fa7 |
| Source of Spectrum | EK-1999-375-0 |
| Wiley ID | 1129959 |