| SpectraBase Compound ID | B1qXP2Kkvik |
|---|---|
| InChI | InChI=1S/C12H15N3O4/c1-9(16)13-8-2-3-12(17)14-10-4-6-11(7-5-10)15(18)19/h4-7H,2-3,8H2,1H3,(H,13,16)(H,14,17) |
| InChIKey | AXBWKVNOWZATIX-UHFFFAOYSA-N |
| Mol Weight | 265.27 g/mol |
| Molecular Formula | C12H15N3O4 |
| Exact Mass | 265.106256 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Bo4uGP260t9 |
|---|---|
| Name | 4-(Acetylamino)-N-(4-nitrophenyl)butanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.106255971 u |
| Formula | C12H15N3O4 |
| InChI | InChI=1S/C12H15N3O4/c1-9(16)13-8-2-3-12(17)14-10-4-6-11(7-5-10)15(18)19/h4-7H,2-3,8H2,1H3,(H,13,16)(H,14,17) |
| InChIKey | AXBWKVNOWZATIX-UHFFFAOYSA-N |
| Molecular Weight | 265.269 g/mol |
| SMILES | C1(N(=O)=O)=CC=C(C=C1)NC(=O)CCCNC(=O)C |