| SpectraBase Compound ID | cas3mikdvt |
|---|---|
| InChI | InChI=1S/C10H17NO5/c1-3-4-16-10(14)11-6-7(12)5-8(11)9(13)15-2/h7-8,12H,3-6H2,1-2H3/t7-,8+/m0/s1 |
| InChIKey | FQRSMIMUORRBIT-JGVFFNPUSA-N |
| Mol Weight | 231.25 g/mol |
| Molecular Formula | C10H17NO5 |
| Exact Mass | 231.110673 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DYqXoE6dZ7z |
|---|---|
| Name | Trans-4-hydroxy-L-proline, N-(N-propyloxycarbonyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.110672646 u |
| Formula | C10H17NO5 |
| InChI | InChI=1S/C10H17NO5/c1-3-4-16-10(14)11-6-7(12)5-8(11)9(13)15-2/h7-8,12H,3-6H2,1-2H3/t7-,8+/m0/s1 |
| InChIKey | FQRSMIMUORRBIT-JGVFFNPUSA-N |
| Molecular Weight | 231.248 g/mol |
| SMILES | [C@]1(C[C@](C(=O)OC)(N(C1)C(OCCC)=O)[H])(O)[H] |