| SpectraBase Compound ID | Ax06Wzu48cQ |
|---|---|
| InChI | InChI=1S/C14H9N3O6/c18-13(9-5-1-3-7-11(9)16(20)21)15-14(19)10-6-2-4-8-12(10)17(22)23/h1-8H,(H,15,18,19) |
| InChIKey | RYVAIQRLQHFIHF-UHFFFAOYSA-N |
| Mol Weight | 315.24 g/mol |
| Molecular Formula | C14H9N3O6 |
| Exact Mass | 315.049135 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5NFQ10njC99 |
|---|---|
| Name | Benzamide, 2-nitro-N-(2-nitrobenzoyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.049135016 u |
| Formula | C14H9N3O6 |
| InChI | InChI=1S/C14H9N3O6/c18-13(9-5-1-3-7-11(9)16(20)21)15-14(19)10-6-2-4-8-12(10)17(22)23/h1-8H,(H,15,18,19) |
| InChIKey | RYVAIQRLQHFIHF-UHFFFAOYSA-N |
| Molecular Weight | 315.241 g/mol |
| SMILES | C=1(N(=O)=O)C(C(NC(C=2C(N(=O)=O)=CC=CC2)=O)=O)=CC=CC1 |