| SpectraBase Compound ID | 6z0991N98Yv |
|---|---|
| InChI | InChI=1S/C8H16O2/c1-7(5-9)6-10-8(2,3)4/h5,7H,6H2,1-4H3 |
| InChIKey | LJQSELUIZOLLPW-UHFFFAOYSA-N |
| Mol Weight | 144.21 g/mol |
| Molecular Formula | C8H16O2 |
| Exact Mass | 144.11503 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5pMOoxnm6hH |
|---|---|
| Name | 3-Tert-butoxy-2-methylpropionaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 144.115029753 u |
| Formula | C8H16O2 |
| InChI | InChI=1S/C8H16O2/c1-7(5-9)6-10-8(2,3)4/h5,7H,6H2,1-4H3 |
| InChIKey | LJQSELUIZOLLPW-UHFFFAOYSA-N |
| Molecular Weight | 144.214 g/mol |
| SMILES | C(C)(OCC(C=O)C)(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.979909 |