| SpectraBase Compound ID | 2aapc4sBDB8 |
|---|---|
| InChI | InChI=1S/C8H8N2O3/c9-8(11)5-6-1-3-7(4-2-6)10(12)13/h1-4H,5H2,(H2,9,11) |
| InChIKey | MQNBMOUEKNYZII-UHFFFAOYSA-N |
| Mol Weight | 180.16 g/mol |
| Molecular Formula | C8H8N2O3 |
| Exact Mass | 180.053492 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 26WLCTOzYdw |
|---|---|
| Name | 2-(4-Nitrophenyl)acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.053492123 u |
| Formula | C8H8N2O3 |
| InChI | InChI=1S/C8H8N2O3/c9-8(11)5-6-1-3-7(4-2-6)10(12)13/h1-4H,5H2,(H2,9,11) |
| InChIKey | MQNBMOUEKNYZII-UHFFFAOYSA-N |
| Molecular Weight | 180.163 g/mol |
| SMILES | C1(N(=O)=O)=CC=C(CC(=O)N)C=C1 |