| SpectraBase Compound ID | G4vOLnZ7hZY |
|---|---|
| InChI | InChI=1S/C15H29NO4/c1-12(2)7-6-10-19-13(17)8-9-16-14(18)20-11-15(3,4)5/h12H,6-11H2,1-5H3,(H,16,18) |
| InChIKey | DKNNEGIADBQJLJ-UHFFFAOYSA-N |
| Mol Weight | 287.4 g/mol |
| Molecular Formula | C15H29NO4 |
| Exact Mass | 287.209658 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B7mtVY1vOjY |
|---|---|
| Name | .beta.-Alanine, N-neopentyloxycarbonyl-, isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.209658414 u |
| Formula | C15H29NO4 |
| InChI | InChI=1S/C15H29NO4/c1-12(2)7-6-10-19-13(17)8-9-16-14(18)20-11-15(3,4)5/h12H,6-11H2,1-5H3,(H,16,18) |
| InChIKey | DKNNEGIADBQJLJ-UHFFFAOYSA-N |
| SMILES | CC(COC(NCCC(OCCCC(C)C)=O)=O)(C)C |