| SpectraBase Compound ID | IMdtNE2TYGe |
|---|---|
| InChI | InChI=1S/C19H37NO4/c1-5-6-7-8-9-10-11-12-15-23-17(21)13-14-20-18(22)24-16-19(2,3)4/h5-16H2,1-4H3,(H,20,22) |
| InChIKey | FDGPFQCWYLFVBT-UHFFFAOYSA-N |
| Mol Weight | 343.5 g/mol |
| Molecular Formula | C19H37NO4 |
| Exact Mass | 343.272259 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5u3rnFVEouM |
|---|---|
| Name | .beta.-Alanine, N-neopentyloxycarbonyl-, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.272258671 u |
| Formula | C19H37NO4 |
| InChI | InChI=1S/C19H37NO4/c1-5-6-7-8-9-10-11-12-15-23-17(21)13-14-20-18(22)24-16-19(2,3)4/h5-16H2,1-4H3,(H,20,22) |
| InChIKey | FDGPFQCWYLFVBT-UHFFFAOYSA-N |
| Molecular Weight | 343.508 g/mol |
| SMILES | CC(COC(NCCC(OCCCCCCCCCC)=O)=O)(C)C |