| SpectraBase Compound ID | 4yu2Xn3w6fw |
|---|---|
| InChI | InChI=1S/C7H14O/c1-3-7(2,8)6-4-5-6/h6,8H,3-5H2,1-2H3 |
| InChIKey | SHRBLGWQGLJAOG-UHFFFAOYSA-N |
| Mol Weight | 114.19 g/mol |
| Molecular Formula | C7H14O |
| Exact Mass | 114.104465 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Hn897wd4SLG |
|---|---|
| Name | 2-Cyclopropylbutan-2-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 114.104465070 u |
| Formula | C7H14O |
| InChI | InChI=1S/C7H14O/c1-3-7(2,8)6-4-5-6/h6,8H,3-5H2,1-2H3 |
| InChIKey | SHRBLGWQGLJAOG-UHFFFAOYSA-N |
| Molecular Weight | 114.188 g/mol |
| SMILES | C1CC1C(C)(CC)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.950739 |