| SpectraBase Compound ID | De1GaxF1kCd |
|---|---|
| InChI | InChI=1S/C7H10O/c1-3-5-7(8)6-4-2/h3-6H,1-2H3/b5-3+,6-4+ |
| InChIKey | XQBYLOYJNLQCLU-GGWOSOGESA-N |
| Mol Weight | 110.16 g/mol |
| Molecular Formula | C7H10O |
| Exact Mass | 110.073165 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6fznEDXkabf |
|---|---|
| Name | (2E,5E)-4-hepta-2,5-dienone |
| Alternate Name(s) | (2E,5E)-Hepta-2,5-dien-4-one |
| CAS Registry Number | 71718-46-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H10O |
| InChI | InChI=1S/C7H10O/c1-3-5-7(8)6-4-2/h3-6H,1-2H3/b5-3+,6-4+ |
| InChIKey | XQBYLOYJNLQCLU-GGWOSOGESA-N |
| Molecular Weight | 110.156 g/mol |
| SMILES | C(\C=C\C)(\C=C\C)=O |
| SPLASH | splash10-014u-9000000000-db7e59d0aaef0c1af3f2 |
| Source of Spectrum | K-2001-440-14 |
| Wiley ID | 1578625 |