| SpectraBase Compound ID | B5wYnXOdV0F |
|---|---|
| InChI | InChI=1S/C8H12/c1-2-4-6-8-7-5-3-1/h1-6H2 |
| InChIKey | ZPWOOKQUDFIEIX-UHFFFAOYSA-N |
| Mol Weight | 108.18 g/mol |
| Molecular Formula | C8H12 |
| Exact Mass | 108.0939 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AAa89nme8XQ |
|---|---|
| Name | Cyclooctyne |
| CAS Registry Number | 1781-78-8 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H12 |
| InChI | InChI=1S/C8H12/c1-2-4-6-8-7-5-3-1/h1-6H2 |
| InChIKey | ZPWOOKQUDFIEIX-UHFFFAOYSA-N |
| Literature Reference | H. Petersen, H. Kolshorn, Angew. Chem. 90, 483 (1978). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |