| SpectraBase Compound ID | FyVSCEarya9 |
|---|---|
| InChI | InChI=1S/C10H13NO2/c1-6-5-7(2)9(4)10(8(6)3)11(12)13/h5H,1-4H3 |
| InChIKey | WNDZFRDJVLAHBN-UHFFFAOYSA-N |
| Mol Weight | 179.22 g/mol |
| Molecular Formula | C10H13NO2 |
| Exact Mass | 179.094629 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B1hGZjYhJqq |
|---|---|
| Name | Nitrodurene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H13NO2 |
| InChI | InChI=1S/C10H13NO2/c1-6-5-7(2)9(4)10(8(6)3)11(12)13/h5H,1-4H3 |
| InChIKey | WNDZFRDJVLAHBN-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 179.219 g/mol |
| SMILES | c1(c(c(c(c(c1)C)C)[N+](=O)[O-])C)C |
| SPLASH | splash10-06w9-3900000000-f78025bc277297c88f99 |
| Source of Spectrum | SRH-2022-10557-0 |
| Wiley ID | 1832171 |