| SpectraBase Compound ID | 9tQ3ECavj9s |
|---|---|
| InChI | InChI=1S/C6H6N2/c1-3-8-6(2)4-5-7-8/h1,4-5H,2H3 |
| InChIKey | SWRFGALQGGATIT-UHFFFAOYSA-N |
| Mol Weight | 106.13 g/mol |
| Molecular Formula | C6H6N2 |
| Exact Mass | 106.053098 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DTRoJgHzQQ9 |
|---|---|
| Name | 1-Ethynyl-3-methylpyrazole and 1-ethynyl-5-methylpyrazole (27:73 ratio) |
| Alternate Name(s) | 1-Ethynyl-5-methyl-1H-pyrazole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H6N2 |
| InChI | InChI=1S/C6H6N2/c1-3-8-6(2)4-5-7-8/h1,4-5H,2H3 |
| InChIKey | SWRFGALQGGATIT-UHFFFAOYSA-N |
| Molecular Weight | 106.128 g/mol |
| SMILES | c1n[n](c(c1)C)C#C |
| SPLASH | splash10-0pb9-9600000000-921371b60b8752711b57 |
| Source of Spectrum | B-47-991-0 |
| Wiley ID | 1121371 |