| SpectraBase Compound ID | 3SocTRd3nPR |
|---|---|
| InChI | InChI=1S/C15H27NO3/c1-2-3-12-19-15(18)10-11-16-14(17)9-8-13-6-4-5-7-13/h13H,2-12H2,1H3,(H,16,17) |
| InChIKey | AZFKGAUNZXZOSJ-UHFFFAOYSA-N |
| Mol Weight | 269.38 g/mol |
| Molecular Formula | C15H27NO3 |
| Exact Mass | 269.199094 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Y5UMF8e8zl |
|---|---|
| Name | .beta.-Alanine, N-(3-cyclopentylpropionyl)-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.199093730 u |
| Formula | C15H27NO3 |
| InChI | InChI=1S/C15H27NO3/c1-2-3-12-19-15(18)10-11-16-14(17)9-8-13-6-4-5-7-13/h13H,2-12H2,1H3,(H,16,17) |
| InChIKey | AZFKGAUNZXZOSJ-UHFFFAOYSA-N |
| SMILES | C1(CCCC1)CCC(NCCC(OCCCC)=O)=O |