| SpectraBase Compound ID | KA9Zn8qrvEn |
|---|---|
| InChI | InChI=1S/C8H8/c1-3-5-7-8-6-4-2/h3-5,7H,1-2H2/b7-5+ |
| InChIKey | DYQVQSUVEDCHDD-FNORWQNLSA-N |
| Mol Weight | 104.15 g/mol |
| Molecular Formula | C8H8 |
| Exact Mass | 104.0626 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | VE0zxCkTT4 |
|---|---|
| Name | (3E)-1,3,7-Octatrien-5-yne |
| CAS Registry Number | 57830-27-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H8 |
| InChI | InChI=1S/C8H8/c1-3-5-7-8-6-4-2/h3-5,7H,1-2H2/b7-5+ |
| InChIKey | DYQVQSUVEDCHDD-FNORWQNLSA-N |
| Molecular Weight | 104.152 g/mol |
| SMILES | C(#CC=C)\C=C\C=C |
| SPLASH | splash10-0ui0-9400000000-8f077778c6c0bcb82ece |
| Source of Spectrum | F-54-11040-23 |
| Synonyms | 1,3,7-Octatrien-5-yne (3E)-octa-1,3,7-trien-5-yne |
| Wiley ID | 808801 |