| SpectraBase Compound ID | IbnGfD2alkQ |
|---|---|
| InChI | InChI=1S/C7H14O3/c1-6(2)4-10-5-7(8)9-3/h6H,4-5H2,1-3H3 |
| InChIKey | DIKUIGYOBQUFGP-UHFFFAOYSA-N |
| Mol Weight | 146.19 g/mol |
| Molecular Formula | C7H14O3 |
| Exact Mass | 146.094294 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | L5HtWEcnfc8 |
|---|---|
| Name | Isobutoxyacetic acid, methyl ester |
| 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(2)4-10-5-7(8)9-3/h6H,4-5H2,1-3H3 |
| InChIKey | DIKUIGYOBQUFGP-UHFFFAOYSA-N |
| Molecular Weight | 146.186 g/mol |
| SMILES | CC(COCC(OC)=O)C |
| Spectrum/Structure Validation Score (Raman) | 0.979295 |