| SpectraBase Compound ID | 4BoIB8Xn5qf |
|---|---|
| InChI | InChI=1S/C7H10O/c1-3-5-6-7(8)4-2/h2H,3,5-6H2,1H3 |
| InChIKey | PHUNISWRLXRMIN-UHFFFAOYSA-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 | Bf34nrAQH1 |
|---|---|
| Name | 1-Heptyn-3-one |
| Alternate Name(s) | Hept-1-yn-3-one |
| CAS Registry Number | 26119-02-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H10O |
| InChI | InChI=1S/C7H10O/c1-3-5-6-7(8)4-2/h2H,3,5-6H2,1H3 |
| InChIKey | PHUNISWRLXRMIN-UHFFFAOYSA-N |
| Molecular Weight | 110.156 g/mol |
| SMILES | C(#C)C(=O)CCCC |
| SPLASH | splash10-014i-9000000000-4b256444a54d3475da9e |
| Source of Spectrum | F-39-3078-0 |
| Wiley ID | 1122419 |