| SpectraBase Compound ID | CZFNfuS8Mgd |
|---|---|
| InChI | InChI=1S/C7H12/c1-3-5-7-6-4-2/h3-5H2,1-2H3 |
| InChIKey | KLYHSJRCIZOUHE-UHFFFAOYSA-N |
| Mol Weight | 96.17 g/mol |
| Molecular Formula | C7H12 |
| Exact Mass | 96.0939 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IWZil4ky5Pz |
|---|---|
| Name | 3-Heptyne |
| Alternate Name(s) | 1-Ethyl-2-propylacetylene HEPT-3-YNE EINECS 219-967-7 |
| CAS Registry Number | 2586-89-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12 |
| InChI | InChI=1S/C7H12/c1-3-5-7-6-4-2/h3-5H2,1-2H3 |
| InChIKey | KLYHSJRCIZOUHE-UHFFFAOYSA-N |
| Molecular Weight | 96.173 g/mol |
| SMILES | CCCC#CCC |
| SPLASH | splash10-00np-9000000000-caffe536a88082165e45 |
| Source of Spectrum | AA-0-210-4 |
| Wiley ID | 1333 |