| SpectraBase Compound ID | H19M4RtOSPj |
|---|---|
| InChI | InChI=1S/C19H37NO3/c1-4-5-6-7-8-9-10-11-12-13-16-23-18(21)14-15-20-19(22)17(2)3/h17H,4-16H2,1-3H3,(H,20,22) |
| InChIKey | FRHKQFCECXOUNC-UHFFFAOYSA-N |
| Mol Weight | 327.5 g/mol |
| Molecular Formula | C19H37NO3 |
| Exact Mass | 327.277344 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lua2jgDiMa |
|---|---|
| Name | .beta.-Alanine, N-isobutyryl-, dodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 327.277344052 u |
| Formula | C19H37NO3 |
| InChI | InChI=1S/C19H37NO3/c1-4-5-6-7-8-9-10-11-12-13-16-23-18(21)14-15-20-19(22)17(2)3/h17H,4-16H2,1-3H3,(H,20,22) |
| InChIKey | FRHKQFCECXOUNC-UHFFFAOYSA-N |
| Molecular Weight | 327.509 g/mol |
| SMILES | CC(C)C(NCCC(OCCCCCCCCCCCC)=O)=O |