| SpectraBase Compound ID | E3VLuNoSzct |
|---|---|
| InChI | InChI=1S/C12H12N4O4/c1-20-10-5-3-2-4-9(10)13-12(17)8-15-7-6-11(14-15)16(18)19/h2-7H,8H2,1H3,(H,13,17) |
| InChIKey | IKEQJKLYEPDXRI-UHFFFAOYSA-N |
| Mol Weight | 276.25 g/mol |
| Molecular Formula | C12H12N4O4 |
| Exact Mass | 276.085855 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3CuHrmOE0An |
|---|---|
| Name | 1H-Pyrazole-1-acetamide, N-(2-methoxyphenyl)-3-nitro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.085854878 u |
| Formula | C12H12N4O4 |
| InChI | InChI=1S/C12H12N4O4/c1-20-10-5-3-2-4-9(10)13-12(17)8-15-7-6-11(14-15)16(18)19/h2-7H,8H2,1H3,(H,13,17) |
| InChIKey | IKEQJKLYEPDXRI-UHFFFAOYSA-N |
| SMILES | C1(=CC=CC=C1OC)NC(=O)CN1N=C(C=C1)N(=O)=O |