| SpectraBase Compound ID | HRfEIO7LUPs |
|---|---|
| InChI | InChI=1S/C17H25NO3/c1-13(2)12-21-17(20)11-7-10-16(19)18-14(3)15-8-5-4-6-9-15/h4-6,8-9,13-14H,7,10-12H2,1-3H3,(H,18,19) |
| InChIKey | OYXHSBZAFSFMFR-UHFFFAOYSA-N |
| Mol Weight | 291.39 g/mol |
| Molecular Formula | C17H25NO3 |
| Exact Mass | 291.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4tdmIFc74Sy |
|---|---|
| Name | Glutaric acid, monoamide, N-(1-phenylethyl)-, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.183443666 u |
| Formula | C17H25NO3 |
| InChI | InChI=1S/C17H25NO3/c1-13(2)12-21-17(20)11-7-10-16(19)18-14(3)15-8-5-4-6-9-15/h4-6,8-9,13-14H,7,10-12H2,1-3H3,(H,18,19) |
| InChIKey | OYXHSBZAFSFMFR-UHFFFAOYSA-N |
| SMILES | CC(NC(CCCC(OCC(C)C)=O)=O)C1=CC=CC=C1 |