| SpectraBase Compound ID | ACLjWERzGMe |
|---|---|
| InChI | InChI=1S/C7H8O/c1-2-6-4-3-5-7(6)8/h1,3-5H2 |
| InChIKey | QMHJCXWANSDJDT-UHFFFAOYSA-N |
| Mol Weight | 108.14 g/mol |
| Molecular Formula | C7H8O |
| Exact Mass | 108.057515 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9FD8gKlplIT |
|---|---|
| Name | Cyclopentanone, 2-ethenylidene- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 108.057514877 u |
| Formula | C7H8O |
| InChI | InChI=1S/C7H8O/c1-2-6-4-3-5-7(6)8/h1,3-5H2 |
| InChIKey | QMHJCXWANSDJDT-UHFFFAOYSA-N |
| Molecular Weight | 108.140 g/mol |
| SMILES | C1(=C=C)C(=O)CCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.825029 |