| SpectraBase Compound ID | 9pU2oUKZ8EF |
|---|---|
| InChI | InChI=1S/C15H23NO2/c1-11(2)9-16-14-7-5-6-13(8-14)15(17)18-10-12(3)4/h5-8,11-12,16H,9-10H2,1-4H3 |
| InChIKey | DSEMMODTCBEYPS-UHFFFAOYSA-N |
| Mol Weight | 249.35 g/mol |
| Molecular Formula | C15H23NO2 |
| Exact Mass | 249.172879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GhN1fWviHhb |
|---|---|
| Name | Benzoic acid, 3-(2-methylpropyl)amino-, 2-methylpropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.172878983 u |
| Formula | C15H23NO2 |
| InChI | InChI=1S/C15H23NO2/c1-11(2)9-16-14-7-5-6-13(8-14)15(17)18-10-12(3)4/h5-8,11-12,16H,9-10H2,1-4H3 |
| InChIKey | DSEMMODTCBEYPS-UHFFFAOYSA-N |
| Molecular Weight | 249.354 g/mol |
| SMILES | C1=C(C=CC=C1C(OCC(C)C)=O)NCC(C)C |