| SpectraBase Compound ID | 4fHF9Zrd7fS |
|---|---|
| InChI | InChI=1S/C11H14N2O3/c1-8(2)7-12-11(14)9-3-5-10(6-4-9)13(15)16/h3-6,8H,7H2,1-2H3,(H,12,14) |
| InChIKey | DPXAUDVSHNKGLR-UHFFFAOYSA-N |
| Mol Weight | 222.24 g/mol |
| Molecular Formula | C11H14N2O3 |
| Exact Mass | 222.100442 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KNsMk09Kabz |
|---|---|
| Name | Benzamide, 4-nitro-N-isobutyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.100442316 u |
| Formula | C11H14N2O3 |
| InChI | InChI=1S/C11H14N2O3/c1-8(2)7-12-11(14)9-3-5-10(6-4-9)13(15)16/h3-6,8H,7H2,1-2H3,(H,12,14) |
| InChIKey | DPXAUDVSHNKGLR-UHFFFAOYSA-N |
| Molecular Weight | 222.244 g/mol |
| SMILES | C1=C(C=CC(=C1)N(=O)=O)C(NCC(C)C)=O |