| SpectraBase Compound ID | IvRIKyiIg95 |
|---|---|
| InChI | InChI=1S/C13H25NO4/c1-5-6-9-17-11(15)7-8-14-12(16)18-10-13(2,3)4/h5-10H2,1-4H3,(H,14,16) |
| InChIKey | SDDSCPZLJMWQLR-UHFFFAOYSA-N |
| Mol Weight | 259.35 g/mol |
| Molecular Formula | C13H25NO4 |
| Exact Mass | 259.178358 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3aysAzbizFo |
|---|---|
| Name | .beta.-Alanine, N-neopentyloxycarbonyl-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.178358285 u |
| Formula | C13H25NO4 |
| InChI | InChI=1S/C13H25NO4/c1-5-6-9-17-11(15)7-8-14-12(16)18-10-13(2,3)4/h5-10H2,1-4H3,(H,14,16) |
| InChIKey | SDDSCPZLJMWQLR-UHFFFAOYSA-N |
| Molecular Weight | 259.346 g/mol |
| SMILES | CC(COC(NCCC(OCCCC)=O)=O)(C)C |