![Prop-2-yn-1-yl bicyclo[2.2.1]hept-5-ene-2-carboxylate](/api/spectrum/1LkSNqocnTX/structure.png?h=300&w=458 "Prop-2-yn-1-yl bicyclo[2.2.1]hept-5-ene-2-carboxylate")
| SpectraBase Compound ID | 1074KvhzcGk |
|---|---|
| InChI | InChI=1S/C11H12O2/c1-2-5-13-11(12)10-7-8-3-4-9(10)6-8/h1,3-4,8-10H,5-7H2/t8-,9+,10?/m0/s1 |
| InChIKey | WITAKKIPQQHPBU-UHFFFAOYSA-N |
| Mol Weight | 176.21 g/mol |
| Molecular Formula | C11H12O2 |
| Exact Mass | 176.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1LkSNqocnTX |
|---|---|
| Name | Prop-2-yn-1-yl bicyclo[2.2.1]hept-5-ene-2-carboxylate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 176.083729624 u |
| Formula | C11H12O2 |
| InChI | InChI=1S/C11H12O2/c1-2-5-13-11(12)10-7-8-3-4-9(10)6-8/h1,3-4,8-10H,5-7H2 |
| InChIKey | WITAKKIPQQHPBU-UHFFFAOYSA-N |
| Molecular Weight | 176.215 g/mol |
| SMILES | C(=O)(OCC#C)C1[C@@]2(C=C[C@](C1)(C2)[H])[H] |