| SpectraBase Compound ID | Exyas5kMc23 |
|---|---|
| InChI | InChI=1S/C10H16O2/c11-9-5-4-8-10(12)6-2-1-3-7-10/h4-5,9,12H,1-3,6-8H2/b5-4+ |
| InChIKey | NRXZMLJITIZVIK-SNAWJCMRSA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C10H16O2 |
| Exact Mass | 168.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | L7uVrDNa21y |
|---|---|
| Name | 1-Hydroxy-1-(3-formylprop-2-en-1-yl)cyclohexane |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.115029753 u |
| Formula | C10H16O2 |
| InChI | InChI=1S/C10H16O2/c11-9-5-4-8-10(12)6-2-1-3-7-10/h4-5,9,12H,1-3,6-8H2/b5-4+ |
| InChIKey | NRXZMLJITIZVIK-SNAWJCMRSA-N |
| Molecular Weight | 168.236 g/mol |
| SMILES | C1(O)(C\C=C\C=O)CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.832537 |