| SpectraBase Compound ID | CFQAAm9VjV1 |
|---|---|
| InChI | InChI=1S/C16H23NO4/c1-16(2,3)11-12-21-15(18)6-4-5-13-7-9-14(10-8-13)17(19)20/h7-10H,4-6,11-12H2,1-3H3 |
| InChIKey | OGXPZWBBWKEKJT-UHFFFAOYSA-N |
| Mol Weight | 293.36 g/mol |
| Molecular Formula | C16H23NO4 |
| Exact Mass | 293.162708 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6cjJ2iRjicb |
|---|---|
| Name | 4-(4-Nitrophenyl)butyric acid 3,3-dimethylbutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 293.162708221 u |
| Formula | C16H23NO4 |
| InChI | InChI=1S/C16H23NO4/c1-16(2,3)11-12-21-15(18)6-4-5-13-7-9-14(10-8-13)17(19)20/h7-10H,4-6,11-12H2,1-3H3 |
| InChIKey | OGXPZWBBWKEKJT-UHFFFAOYSA-N |
| SMILES | C(CCCC=1C=CC(=CC1)N(=O)=O)(=O)OCCC(C)(C)C |