| SpectraBase Compound ID | KQp0PfRmJsJ |
|---|---|
| InChI | InChI=1S/C12H10/c1-3-5-11-7-9-12(6-4-2)10-8-11/h7-10H,1-2H3 |
| InChIKey | JQERGZDDUGLLIS-UHFFFAOYSA-N |
| Mol Weight | 154.21 g/mol |
| Molecular Formula | C12H10 |
| Exact Mass | 154.07825 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HRjlVzpERCM |
|---|---|
| Name | 1,4-bis(Prop-1-ynyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 154.078250322 u |
| Formula | C12H10 |
| InChI | InChI=1S/C12H10/c1-3-5-11-7-9-12(6-4-2)10-8-11/h7-10H,1-2H3 |
| InChIKey | JQERGZDDUGLLIS-UHFFFAOYSA-N |
| Molecular Weight | 154.212 g/mol |
| SMILES | C=1C(C#CC)=CC=C(C#CC)C1 |