| SpectraBase Compound ID | 6kkaj04EXrd |
|---|---|
| InChI | InChI=1S/C19H23NO3/c1-2-3-6-14-23-18(21)12-13-20-19(22)17-11-7-9-15-8-4-5-10-16(15)17/h4-5,7-11H,2-3,6,12-14H2,1H3,(H,20,22) |
| InChIKey | RULLWQMUNZCPFX-UHFFFAOYSA-N |
| Mol Weight | 313.4 g/mol |
| Molecular Formula | C19H23NO3 |
| Exact Mass | 313.167794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lv65ZR5Wbj1 |
|---|---|
| Name | .beta.-Alanine, N-(1-naphthoyl)-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 313.167793602 u |
| Formula | C19H23NO3 |
| InChI | InChI=1S/C19H23NO3/c1-2-3-6-14-23-18(21)12-13-20-19(22)17-11-7-9-15-8-4-5-10-16(15)17/h4-5,7-11H,2-3,6,12-14H2,1H3,(H,20,22) |
| InChIKey | RULLWQMUNZCPFX-UHFFFAOYSA-N |
| Molecular Weight | 313.397 g/mol |
| SMILES | C1=2C(=CC=CC2C(NCCC(OCCCCC)=O)=O)C=CC=C1 |