| SpectraBase Compound ID | 3UNpKaVH5iC |
|---|---|
| InChI | InChI=1S/C6H8/c1-3-5-6-4-2/h4-6H,1H2,2H3/b6-4+ |
| InChIKey | NETPEWDFCPYQCU-GQCTYLIASA-N |
| Mol Weight | 80.13 g/mol |
| Molecular Formula | C6H8 |
| Exact Mass | 80.0626 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6pG6QySDaI2 |
|---|---|
| Name | Trans-1,2,4-hexatriene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 80.062600258 u |
| Formula | C6H8 |
| InChI | InChI=1S/C6H8/c1-3-5-6-4-2/h4-6H,1H2,2H3/b6-4+ |
| InChIKey | NETPEWDFCPYQCU-GQCTYLIASA-N |
| Molecular Weight | 80.130 g/mol |
| SMILES | C(\C=C\C)=C=C |