| SpectraBase Compound ID | 2Ubc1XhonNy |
|---|---|
| InChI | InChI=1S/C6H6/c1-4-6(3)5-2/h1-2,6H,3H3 |
| InChIKey | IIRXCFIWJAELDL-UHFFFAOYSA-N |
| Mol Weight | 78.11 g/mol |
| Molecular Formula | C6H6 |
| Exact Mass | 78.04695 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2R5AHHpuuu |
|---|---|
| Name | 3-Methylpenta-1,4-diyne |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H6 |
| InChI | InChI=1S/C6H6/c1-4-6(3)5-2/h1-2,6H,3H3 |
| InChIKey | IIRXCFIWJAELDL-UHFFFAOYSA-N |
| Molecular Weight | 78.114 g/mol |
| SMILES | C#CC(C#C)C |
| SPLASH | splash10-0h09-9000000000-1611e6bd2503cf2f03af |
| Source of Spectrum | U-1995-1107-207 |
| Wiley ID | 766965 |