| SpectraBase Compound ID | DxC4g31xgiN |
|---|---|
| InChI | InChI=1S/C14H22/c1-13(2)11-9-7-5-6-8-10-12-14(3)4/h13-14H,9-12H2,1-4H3 |
| InChIKey | VYZQJMVUWAJFIK-UHFFFAOYSA-N |
| Mol Weight | 190.33 g/mol |
| Molecular Formula | C14H22 |
| Exact Mass | 190.172151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LoX7jbfTw3z |
|---|---|
| Name | 2,11-Dimethyl-5,7-dodecadiyne |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.172150708 u |
| Formula | C14H22 |
| InChI | InChI=1S/C14H22/c1-13(2)11-9-7-5-6-8-10-12-14(3)4/h13-14H,9-12H2,1-4H3 |
| InChIKey | VYZQJMVUWAJFIK-UHFFFAOYSA-N |
| Molecular Weight | 190.330 g/mol |
| SMILES | C(C#CCCC(C)C)#CCCC(C)C |