| SpectraBase Compound ID | LT7ezgKWXCi |
|---|---|
| InChI | InChI=1S/C8H6/c1-2-8-6-4-3-5-7-8/h1,3-7H |
| InChIKey | UEXCJVNBTNXOEH-UHFFFAOYSA-N |
| Mol Weight | 102.14 g/mol |
| Molecular Formula | C8H6 |
| Exact Mass | 102.04695 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9nqkBQEMYCm |
|---|---|
| Name | phenylacetylene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H6 |
| InChI | InChI=1S/C8H6/c1-2-8-6-4-3-5-7-8/h1,3-7H |
| InChIKey | UEXCJVNBTNXOEH-UHFFFAOYSA-N |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/cctc.202001158 |
| Molecular Weight | 102.136 g/mol |
| SMILES | c1cc(ccc1)C#C |
| SPLASH | splash10-0udi-9700000000-db30572ea5b89cc8b507 |
| Source of Spectrum | CCC-12-SM54-phenylacetylene |
| Wiley ID | 1856143 |