| SpectraBase Compound ID | Hxjz2rIJPqa |
|---|---|
| InChI | InChI=1S/C15H22N2O3/c1-4-10-16(11-9-12(2)3)15(18)13-5-7-14(8-6-13)17(19)20/h5-8,12H,4,9-11H2,1-3H3 |
| InChIKey | IXGJFGVPLKNDTA-UHFFFAOYSA-N |
| Mol Weight | 278.35 g/mol |
| Molecular Formula | C15H22N2O3 |
| Exact Mass | 278.163043 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DVFYTyXou2F |
|---|---|
| Name | Benzamide, 4-nitro-N-propyl-N-(3-methylbutyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.163042573 u |
| Formula | C15H22N2O3 |
| InChI | InChI=1S/C15H22N2O3/c1-4-10-16(11-9-12(2)3)15(18)13-5-7-14(8-6-13)17(19)20/h5-8,12H,4,9-11H2,1-3H3 |
| InChIKey | IXGJFGVPLKNDTA-UHFFFAOYSA-N |
| SMILES | C(=O)(N(CCC)CCC(C)C)C=1C=CC(=CC1)N(=O)=O |