![2-Propanone, 1-[(3-methyl-2-butenyl)oxy]-](/api/spectrum/3gA6iAaJiD0/structure.png?h=300&w=458 "2-Propanone, 1-[(3-methyl-2-butenyl)oxy]-")
| SpectraBase Compound ID | DvnukRbvW3S |
|---|---|
| InChI | InChI=1S/C8H14O2/c1-7(2)4-5-10-6-8(3)9/h4H,5-6H2,1-3H3 |
| InChIKey | ZRYWPVJHLFGQSJ-UHFFFAOYSA-N |
| Mol Weight | 142.2 g/mol |
| Molecular Formula | C8H14O2 |
| Exact Mass | 142.09938 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3gA6iAaJiD0 |
|---|---|
| Name | 2-Propanone, 1-[(3-methyl-2-butenyl)oxy]- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 142.099379689 u |
| Formula | C8H14O2 |
| InChI | InChI=1S/C8H14O2/c1-7(2)4-5-10-6-8(3)9/h4H,5-6H2,1-3H3 |
| InChIKey | ZRYWPVJHLFGQSJ-UHFFFAOYSA-N |
| Molecular Weight | 142.198 g/mol |
| SMILES | C(=CCOCC(=O)C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.920652 |