| SpectraBase Compound ID | Sw6hItX3Uk |
|---|---|
| InChI | InChI=1S/C15H19NO4/c1-2-11-5-3-4-6-14(11)20-15(17)12-7-9-13(10-8-12)16(18)19/h7-11,14H,2-6H2,1H3 |
| InChIKey | HJLIWZBFQZVJRK-UHFFFAOYSA-N |
| Mol Weight | 277.32 g/mol |
| Molecular Formula | C15H19NO4 |
| Exact Mass | 277.131408 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HzxtpVvajBe |
|---|---|
| Name | 4-Nitrobenzoic acid, 2-ethylcyclohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.131408092 u |
| Formula | C15H19NO4 |
| InChI | InChI=1S/C15H19NO4/c1-2-11-5-3-4-6-14(11)20-15(17)12-7-9-13(10-8-12)16(18)19/h7-11,14H,2-6H2,1H3 |
| InChIKey | HJLIWZBFQZVJRK-UHFFFAOYSA-N |
| SMILES | C1(C(CCCC1)CC)OC(=O)C=1C=CC(N(=O)=O)=CC1 |