| SpectraBase Compound ID | CTIHHR47gVk |
|---|---|
| InChI | InChI=1S/C5H6O5/c1-9-5(8)3-2(10-3)4(6)7/h2-3H,1H3,(H,6,7)/t2-,3+/m0/s1 |
| InChIKey | HOMGCVPJOFSUEQ-STHAYSLISA-N |
| Mol Weight | 146.1 g/mol |
| Molecular Formula | C5H6O5 |
| Exact Mass | 146.021523 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DixbKZj1AFY |
|---|---|
| Name | (2S,3R)-3-Carbomethoxyoxirane-2-carboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.021523288 u |
| Formula | C5H6O5 |
| InChI | InChI=1S/C5H6O5/c1-9-5(8)3-2(10-3)4(6)7/h2-3H,1H3,(H,6,7)/t2-,3+/m0/s1 |
| InChIKey | HOMGCVPJOFSUEQ-STHAYSLISA-N |
| Molecular Weight | 146.098 g/mol |
| SMILES | [C@@]1([C@](C(=O)OC)(O1)[H])(C(=O)O)[H] |