| SpectraBase Compound ID | FqrJl2xsNFv |
|---|---|
| InChI | InChI=1S/C9H19NO3/c1-6(13-9(2,3)4)7(10)8(11)12-5/h6-7H,10H2,1-5H3 |
| InChIKey | FJJWGZOCZQHVEO-UHFFFAOYSA-N |
| Mol Weight | 189.25 g/mol |
| Molecular Formula | C9H19NO3 |
| Exact Mass | 189.136493 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H2EL4JncaYw |
|---|---|
| Name | o-Tert.-butyl-L-threonine, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.136493473 u |
| Formula | C9H19NO3 |
| InChI | InChI=1S/C9H19NO3/c1-6(13-9(2,3)4)7(10)8(11)12-5/h6-7H,10H2,1-5H3 |
| InChIKey | FJJWGZOCZQHVEO-UHFFFAOYSA-N |
| Molecular Weight | 189.255 g/mol |
| SMILES | C(OC(C(C(OC)=O)N)C)(C)(C)C |