| SpectraBase Compound ID | IlOxpzSi2GP |
|---|---|
| InChI | InChI=1S/C9H8N2O2/c1-6-3-8(5-10)4-9(7(6)2)11(12)13/h3-4H,1-2H3 |
| InChIKey | SARRHHOGHADAJU-UHFFFAOYSA-N |
| Mol Weight | 176.17 g/mol |
| Molecular Formula | C9H8N2O2 |
| Exact Mass | 176.058578 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LnJTkeOLsaT |
|---|---|
| Name | 3,4-Dimethyl-5-nitrobenzonitrile |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H8N2O2 |
| InChI | InChI=1S/C9H8N2O2/c1-6-3-8(5-10)4-9(7(6)2)11(12)13/h3-4H,1-2H3 |
| InChIKey | SARRHHOGHADAJU-UHFFFAOYSA-N |
| Molecular Weight | 176.175 g/mol |
| SMILES | c1(N(=O)=O)c(c(C)cc(C#N)c1)C |
| SPLASH | splash10-08fr-1900000000-642bb019f2a2e4accbbd |
| Source of Spectrum | KC-1983-1005-0 |
| Synonyms | 3,4-Dimethyl-5-nitro-benzenecarbonitrile |
| Wiley ID | 1172087 |