| SpectraBase Compound ID | 8DB8SzHH7uF |
|---|---|
| InChI | InChI=1S/C8H15NO4/c1-4-13-8(11)9-5-6(2)7(10)12-3/h6H,4-5H2,1-3H3,(H,9,11)/t6-/m1/s1 |
| InChIKey | XQTCUDPJTFLHIY-ZCFIWIBFSA-N |
| Mol Weight | 189.21 g/mol |
| Molecular Formula | C8H15NO4 |
| Exact Mass | 189.100108 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JWaJUGDsVoM |
|---|---|
| Name | L-3-Aminoisobutyric acid, N-ethoxycarbonyl-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.100107963 u |
| Formula | C8H15NO4 |
| InChI | InChI=1S/C8H15NO4/c1-4-13-8(11)9-5-6(2)7(10)12-3/h6H,4-5H2,1-3H3,(H,9,11)/t6-/m1/s1 |
| InChIKey | XQTCUDPJTFLHIY-ZCFIWIBFSA-N |
| Molecular Weight | 189.211 g/mol |
| SMILES | C(NC(OCC)=O)[C@@](C)(C(OC)=O)[H] |