| SpectraBase Compound ID | GBqKYc6TQXZ |
|---|---|
| InChI | InChI=1S/C8H14O3/c1-3-11-8(10)7(2)5-4-6-9/h6-7H,3-5H2,1-2H3 |
| InChIKey | NOFXCIBVNCFKMV-UHFFFAOYSA-N |
| Mol Weight | 158.2 g/mol |
| Molecular Formula | C8H14O3 |
| Exact Mass | 158.094294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FlAKxvIIy6r |
|---|---|
| Name | Glutaraldehydic acid, 2-methyl-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.094294308 u |
| Formula | C8H14O3 |
| InChI | InChI=1S/C8H14O3/c1-3-11-8(10)7(2)5-4-6-9/h6-7H,3-5H2,1-2H3 |
| InChIKey | NOFXCIBVNCFKMV-UHFFFAOYSA-N |
| Molecular Weight | 158.197 g/mol |
| SMILES | C(=O)CCC(C(OCC)=O)C |