| 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 |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K3TLwP1Acfd |
|---|---|
| Name | FREE-PHENYLACETYLENE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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 |
| Literature Reference Author | E.J.STOEBENAU,R.F.JORDAN |
| Literature Reference Citation | J.AM.CHEM.SOC.,125,3222(2003) |
| Literature Reference DOI | 10.1021/ja029963j |
| Molecular Weight | 102.136 g/mol |
| Sample ID | 40775 |
| Solvent | CD2Cl2 |