| SpectraBase Compound ID | 5DQmeyW0zud |
|---|---|
| InChI | InChI=1S/C8H12O/c1-2-3-4-5-6-7-8-9/h8H,2-5H2,1H3 |
| InChIKey | DUUGWLGPIZCNLM-UHFFFAOYSA-N |
| Mol Weight | 124.18 g/mol |
| Molecular Formula | C8H12O |
| Exact Mass | 124.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7q5bFk9Z5PT |
|---|---|
| Name | 2-Octynal |
| CAS Registry Number | 1846-68-0 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H12O |
| InChI | InChI=1S/C8H12O/c1-2-3-4-5-6-7-8-9/h8H,2-5H2,1H3 |
| InChIKey | DUUGWLGPIZCNLM-UHFFFAOYSA-N |
| Molecular Weight | 124.183 g/mol |
| SMILES | C(#CCCCCC)C=O |
| SPLASH | splash10-05r4-9000000000-0cc1560ee793f149aff6 |
| Source of Spectrum | J-43-3608-0 |
| Synonyms | OCT-2-YNAL EINECS 217-427-5 |
| Wiley ID | 1128877 |