![2-{[(tert-butoxy)carbonyl]amino}pentanoic acid](/api/spectrum/2VSMKFhhq3C/structure.png?h=300&w=458 "2-{[(tert-butoxy)carbonyl]amino}pentanoic acid")
| SpectraBase Compound ID | 13RfklfNkUx |
|---|---|
| InChI | InChI=1S/C10H19NO4/c1-5-6-7(8(12)13)11-9(14)15-10(2,3)4/h7H,5-6H2,1-4H3,(H,11,14)(H,12,13) |
| InChIKey | INWOAUUPYIXDHN-UHFFFAOYSA-N |
| Mol Weight | 217.26 g/mol |
| Molecular Formula | C10H19NO4 |
| Exact Mass | 217.131408 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2VSMKFhhq3C |
|---|---|
| Name | 2-{[(tert-butoxy)carbonyl]amino}pentanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.131408092 u |
| Formula | C10H19NO4 |
| InChI | InChI=1S/C10H19NO4/c1-5-6-7(8(12)13)11-9(14)15-10(2,3)4/h7H,5-6H2,1-4H3,(H,11,14)(H,12,13) |
| InChIKey | INWOAUUPYIXDHN-UHFFFAOYSA-N |
| Molecular Weight | 217.265 g/mol |
| SMILES | C(C(CCC)NC(=O)OC(C)(C)C)(=O)O |