| SpectraBase Compound ID | 1u8HFEkBpHI |
|---|---|
| InChI | InChI=1S/C8H14/c1-4-6-8(3)7-5-2/h4,6H,1,5,7H2,2-3H3/b8-6+ |
| InChIKey | AHWGKLXMXHPYBI-SOFGYWHQSA-N |
| Mol Weight | 110.2 g/mol |
| Molecular Formula | C8H14 |
| Exact Mass | 110.10955 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IgvlUm30Ir0 |
|---|---|
| Name | 4-Methyl-1,3-heptadiene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 110.109550451 u |
| Formula | C8H14 |
| InChI | InChI=1S/C8H14/c1-4-6-8(3)7-5-2/h4,6H,1,5,7H2,2-3H3/b8-6+ |
| InChIKey | AHWGKLXMXHPYBI-SOFGYWHQSA-N |
| Molecular Weight | 110.200 g/mol |
| SMILES | CCC\C(=C\C=C)C |