| SpectraBase Compound ID | 9pIz00Dnaxj |
|---|---|
| InChI | InChI=1S/C6H12O3/c1-3-5(7)6(8)9-4-2/h5,7H,3-4H2,1-2H3 |
| InChIKey | KWWOQRSLYPHAMK-UHFFFAOYSA-N |
| Mol Weight | 132.16 g/mol |
| Molecular Formula | C6H12O3 |
| Exact Mass | 132.078644 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FE98Go7bI8x |
|---|---|
| Name | Butanoic acid, 2-hydroxy-, ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 132.078644243 u |
| Formula | C6H12O3 |
| InChI | InChI=1S/C6H12O3/c1-3-5(7)6(8)9-4-2/h5,7H,3-4H2,1-2H3 |
| InChIKey | KWWOQRSLYPHAMK-UHFFFAOYSA-N |
| SMILES | C(C(OCC)=O)(CC)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.976295 |