| SpectraBase Compound ID | PwKNKFmxNw |
|---|---|
| InChI | InChI=1S/C10H14O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h5,7-8H,2-4,6H2,1H3 |
| InChIKey | MAUFTTLGOUBZNA-UHFFFAOYSA-N |
| Mol Weight | 166.22 g/mol |
| Molecular Formula | C10H14O2 |
| Exact Mass | 166.09938 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | EMpeh0Ixeoh |
|---|---|
| Name | 6-N-Pentyl-2H-pyran-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 166.099379689 u |
| Formula | C10H14O2 |
| InChI | InChI=1S/C10H14O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h5,7-8H,2-4,6H2,1H3 |
| InChIKey | MAUFTTLGOUBZNA-UHFFFAOYSA-N |
| Molecular Weight | 166.220 g/mol |
| SMILES | C1(OC(=CC=C1)CCCCC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.845515 |