| SpectraBase Compound ID | bHdhExs5U9 |
|---|---|
| InChI | InChI=1S/C8H12O/c1-2-4-7-5-3-6-8(7)9/h2,7H,1,3-6H2 |
| InChIKey | RJBLLIUKFYNXNM-UHFFFAOYSA-N |
| Mol Weight | 124.18 g/mol |
| Molecular Formula | C8H12O |
| Exact Mass | 124.088815 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5KtuTS5ODVT |
|---|---|
| Name | 2-Allylcyclopentanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 124.088815005 u |
| Formula | C8H12O |
| InChI | InChI=1S/C8H12O/c1-2-4-7-5-3-6-8(7)9/h2,7H,1,3-6H2 |
| InChIKey | RJBLLIUKFYNXNM-UHFFFAOYSA-N |
| Molecular Weight | 124.183 g/mol |
| SMILES | C1(=O)C(CC=C)CCC1 |