| SpectraBase Compound ID | 9OKk1CbQtlK |
|---|---|
| InChI | InChI=1S/C7H14O3/c1-6(9-3)4-5-10-7(2)8/h6H,4-5H2,1-3H3 |
| InChIKey | QMYGFTJCQFEDST-UHFFFAOYSA-N |
| Mol Weight | 146.19 g/mol |
| Molecular Formula | C7H14O3 |
| Exact Mass | 146.094294 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | J1yLO9A0nNk |
|---|---|
| Name | 3-Methoxy-1-butanol, acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.094294308 u |
| Formula | C7H14O3 |
| InChI | InChI=1S/C7H14O3/c1-6(9-3)4-5-10-7(2)8/h6H,4-5H2,1-3H3 |
| InChIKey | QMYGFTJCQFEDST-UHFFFAOYSA-N |
| Molecular Weight | 146.186 g/mol |
| SMILES | CC(OCCC(OC)C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.951122 |