| SpectraBase Compound ID | HBpc7LykPpa |
|---|---|
| InChI | InChI=1S/C12H19N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-5,8-11H2,1H3 |
| InChIKey | MMEHJKIXLJJVJX-UHFFFAOYSA-N |
| Mol Weight | 177.29 g/mol |
| Molecular Formula | C12H19N |
| Exact Mass | 177.15175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4WumJAsBBjQ |
|---|---|
| Name | Dodec-6-yne-1-nitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.151749616 u |
| Formula | C12H19N |
| InChI | InChI=1S/C12H19N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-5,8-11H2,1H3 |
| InChIKey | MMEHJKIXLJJVJX-UHFFFAOYSA-N |
| Molecular Weight | 177.291 g/mol |
| SMILES | C(CCCCC#CCCCCC)#N |