| SpectraBase Compound ID | IpaIXW5KN3b |
|---|---|
| InChI | InChI=1S/C9H16O2/c1-7(5-10)9-4-2-3-8(9)6-11/h3,7,9-11H,2,4-6H2,1H3 |
| InChIKey | QXNOYOURTQNOSX-UHFFFAOYSA-N |
| Mol Weight | 156.22 g/mol |
| Molecular Formula | C9H16O2 |
| Exact Mass | 156.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EEVEp7KDOET |
|---|---|
| Name | 2-(Hydroxymethyl)-.beta.-methyl-2-cyclopentene-ethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.115029753 u |
| Formula | C9H16O2 |
| InChI | InChI=1S/C9H16O2/c1-7(5-10)9-4-2-3-8(9)6-11/h3,7,9-11H,2,4-6H2,1H3 |
| InChIKey | QXNOYOURTQNOSX-UHFFFAOYSA-N |
| Molecular Weight | 156.225 g/mol |
| SMILES | C=1(C(C(CO)C)CCC1)CO |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.905029 |