| SpectraBase Compound ID | FVVIU81z1Qg |
|---|---|
| InChI | InChI=1S/C16H23NO3/c1-3-4-11-20-16(19)10-6-9-15(18)17-14-8-5-7-13(2)12-14/h5,7-8,12H,3-4,6,9-11H2,1-2H3,(H,17,18) |
| InChIKey | YMYHJKPNNNOJGM-UHFFFAOYSA-N |
| Mol Weight | 277.36 g/mol |
| Molecular Formula | C16H23NO3 |
| Exact Mass | 277.167794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ATYPMahTeAd |
|---|---|
| Name | Glutaric acid, monoamide, N-(3-methylphenyl)-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.167793602 u |
| Formula | C16H23NO3 |
| InChI | InChI=1S/C16H23NO3/c1-3-4-11-20-16(19)10-6-9-15(18)17-14-8-5-7-13(2)12-14/h5,7-8,12H,3-4,6,9-11H2,1-2H3,(H,17,18) |
| InChIKey | YMYHJKPNNNOJGM-UHFFFAOYSA-N |
| SMILES | C1=CC(=CC(=C1)NC(CCCC(OCCCC)=O)=O)C |