![2-Propanol, 1-[(1-methylethenyl)oxy]-](/api/spectrum/EQFhqpmM5mY/structure.png?h=300&w=458 "2-Propanol, 1-[(1-methylethenyl)oxy]-")
| SpectraBase Compound ID | 4jMOyk9pHCl |
|---|---|
| InChI | InChI=1S/C6H12O2/c1-5(2)8-4-6(3)7/h6-7H,1,4H2,2-3H3 |
| InChIKey | CLVIPGJODNBARE-UHFFFAOYSA-N |
| Mol Weight | 116.16 g/mol |
| Molecular Formula | C6H12O2 |
| Exact Mass | 116.08373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EQFhqpmM5mY |
|---|---|
| Name | 2-Propanol, 1-[(1-methylethenyl)oxy]- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 116.083729624 u |
| Formula | C6H12O2 |
| InChI | InChI=1S/C6H12O2/c1-5(2)8-4-6(3)7/h6-7H,1,4H2,2-3H3 |
| InChIKey | CLVIPGJODNBARE-UHFFFAOYSA-N |
| Molecular Weight | 116.160 g/mol |
| SMILES | C(OCC(O)C)(=C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.953949 |