| SpectraBase Compound ID | DlpV467OJl8 |
|---|---|
| InChI | InChI=1S/C15H31ClO3/c1-11(2)7-17-10-14(16)15(18-8-12(3)4)19-9-13(5)6/h11-15H,7-10H2,1-6H3 |
| InChIKey | RXITVLFZHXYZLO-UHFFFAOYSA-N |
| Mol Weight | 294.86 g/mol |
| Molecular Formula | C15H31ClO3 |
| Exact Mass | 294.196173 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Lww20nBZSLo |
|---|---|
| Name | Propionaldehyde, 2-chloro-3-isobutoxy-, diisobutyl acetal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.196172555 u |
| Formula | C15H31ClO3 |
| InChI | InChI=1S/C15H31ClO3/c1-11(2)7-17-10-14(16)15(18-8-12(3)4)19-9-13(5)6/h11-15H,7-10H2,1-6H3 |
| InChIKey | RXITVLFZHXYZLO-UHFFFAOYSA-N |
| SMILES | C(COCC(C(OCC(C)C)OCC(C)C)Cl)(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.982659 |