![Methyl 2-([(benzyloxy)carbonyl]amino)-3-hydroxybutanoate](/api/spectrum/57Bq0uFepDO/structure.png?h=300&w=458 "Methyl 2-([(benzyloxy)carbonyl]amino)-3-hydroxybutanoate")
| SpectraBase Compound ID | Ibl2X8TP8LS |
|---|---|
| InChI | InChI=1S/C13H17NO5/c1-9(15)11(12(16)18-2)14-13(17)19-8-10-6-4-3-5-7-10/h3-7,9,11,15H,8H2,1-2H3,(H,14,17) |
| InChIKey | OPZWAOJFQFYYIX-UHFFFAOYSA-N |
| Mol Weight | 267.28 g/mol |
| Molecular Formula | C13H17NO5 |
| Exact Mass | 267.110673 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 57Bq0uFepDO |
|---|---|
| Name | Methyl 2-([(benzyloxy)carbonyl]amino)-3-hydroxybutanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.110672646 u |
| Formula | C13H17NO5 |
| InChI | InChI=1S/C13H17NO5/c1-9(15)11(12(16)18-2)14-13(17)19-8-10-6-4-3-5-7-10/h3-7,9,11,15H,8H2,1-2H3,(H,14,17) |
| InChIKey | OPZWAOJFQFYYIX-UHFFFAOYSA-N |
| Molecular Weight | 267.281 g/mol |
| SMILES | C(=O)(C(NC(OCC1=CC=CC=C1)=O)C(C)O)OC |