| SpectraBase Compound ID | 5In1k3g6BGp |
|---|---|
| InChI | InChI=1S/C12H22/c1-3-5-7-9-11-12-10-8-6-4-2/h3,5,7,9H,4,6,8,10-12H2,1-2H3/b5-3+,9-7- |
| InChIKey | NJMCFBIRFRIKSQ-PKWCJPJFSA-N |
| Mol Weight | 166.31 g/mol |
| Molecular Formula | C12H22 |
| Exact Mass | 166.172151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 625UrrCQzCQ |
|---|---|
| Name | 2,4-Dodecadiene, (E,Z)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.172150708 u |
| Formula | C12H22 |
| InChI | InChI=1S/C12H22/c1-3-5-7-9-11-12-10-8-6-4-2/h3,5,7,9H,4,6,8,10-12H2,1-2H3/b5-3+,9-7- |
| InChIKey | NJMCFBIRFRIKSQ-PKWCJPJFSA-N |
| Molecular Weight | 166.308 g/mol |
| SMILES | CCCCCCC\C=C/C=C/C |