| SpectraBase Compound ID | EQYUoIRode4 |
|---|---|
| InChI | InChI=1S/C9H14O3/c1-2-3-5-8(11)9(12)6-4-7-10/h7H,2-6H2,1H3 |
| InChIKey | BAKWHAWPNUHUOV-UHFFFAOYSA-N |
| Mol Weight | 170.21 g/mol |
| Molecular Formula | C9H14O3 |
| Exact Mass | 170.094294 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | FG1OGpZ4DCw |
|---|---|
| Name | 4,5-Dioxononanal |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H14O3 |
| InChI | InChI=1S/C9H14O3/c1-2-3-5-8(11)9(12)6-4-7-10/h7H,2-6H2,1H3 |
| InChIKey | BAKWHAWPNUHUOV-UHFFFAOYSA-N |
| Molecular Weight | 170.208 g/mol |
| SMILES | C(CCC(C(CCCC)=O)=O)=O |
| SPLASH | splash10-0a50-9000000000-3387ad10d1ac0c47c2eb |
| Source of Spectrum | SO-0-410-6 |
| Wiley ID | 1541387 |