| SpectraBase Compound ID | KTlt1Y8wtnq |
|---|---|
| InChI | InChI=1S/C10H14O3/c1-3-7(2)6-9-10(12)8(11)4-5-13-9/h4-5,7,12H,3,6H2,1-2H3 |
| InChIKey | GMLFCMBNIMNXGY-UHFFFAOYSA-N |
| Mol Weight | 182.22 g/mol |
| Molecular Formula | C10H14O3 |
| Exact Mass | 182.094294 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | BlFAvc8Dnhc |
|---|---|
| Name | 3-Hydroxy-2-(2'-methylbutyl)-4-pyrone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.094294308 u |
| Formula | C10H14O3 |
| InChI | InChI=1S/C10H14O3/c1-3-7(2)6-9-10(12)8(11)4-5-13-9/h4-5,7,12H,3,6H2,1-2H3 |
| InChIKey | GMLFCMBNIMNXGY-UHFFFAOYSA-N |
| Molecular Weight | 182.219 g/mol |
| SMILES | C1(=C(OC=CC1=O)CC(CC)C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.866117 |