| SpectraBase Compound ID | 2SXj0NVA1LL |
|---|---|
| InChI | InChI=1S/C9H14/c1-5-6-7-9(4)8(2)3/h1H,6-7H2,2-4H3 |
| InChIKey | CADCXUCTRMKCJF-UHFFFAOYSA-N |
| Mol Weight | 122.21 g/mol |
| Molecular Formula | C9H14 |
| Exact Mass | 122.10955 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KkIZ6HVcdI0 |
|---|---|
| Name | 5,6-Dimethyl-5-hepten-1-yen |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 122.109550451 u |
| Formula | C9H14 |
| InChI | InChI=1S/C9H14/c1-5-6-7-9(4)8(2)3/h1H,6-7H2,2-4H3 |
| InChIKey | CADCXUCTRMKCJF-UHFFFAOYSA-N |
| Molecular Weight | 122.211 g/mol |
| SMILES | C(#C)CCC(=C(C)C)C |