| SpectraBase Compound ID | DSMW1DSTkE8 |
|---|---|
| InChI | InChI=1S/C7H14O4/c1-9-6(8)4-5-7(10-2)11-3/h7H,4-5H2,1-3H3 |
| InChIKey | MMRXJPOAPCEDLP-UHFFFAOYSA-N |
| Mol Weight | 162.18 g/mol |
| Molecular Formula | C7H14O4 |
| Exact Mass | 162.089209 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 4tQCdz67exh |
|---|---|
| Name | Succinaldehydic acid, methyl ester, 4-(dimethyl acetal) |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 162.089208927 u |
| Formula | C7H14O4 |
| InChI | InChI=1S/C7H14O4/c1-9-6(8)4-5-7(10-2)11-3/h7H,4-5H2,1-3H3 |
| InChIKey | MMRXJPOAPCEDLP-UHFFFAOYSA-N |
| Molecular Weight | 162.185 g/mol |
| SMILES | C(C(OC)OC)CC(=O)OC |
| Spectrum/Structure Validation Score (Raman) | 0.949521 |