| SpectraBase Compound ID | 9hSdAttFJ0D |
|---|---|
| InChI | InChI=1S/C8H6N2O3/c9-4-3-6-5-7(11)1-2-8(6)10(12)13/h1-2,5,11H,3H2 |
| InChIKey | LUXNBNQLOOAEMT-UHFFFAOYSA-N |
| Mol Weight | 178.15 g/mol |
| Molecular Formula | C8H6N2O3 |
| Exact Mass | 178.037842 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BZHgEvVj5Xn |
|---|---|
| Name | 2-(2-nitro-5-oxidanyl-phenyl)ethanenitrile |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H6N2O3 |
| InChI | InChI=1S/C8H6N2O3/c9-4-3-6-5-7(11)1-2-8(6)10(12)13/h1-2,5,11H,3H2 |
| InChIKey | LUXNBNQLOOAEMT-UHFFFAOYSA-N |
| Molecular Weight | 178.147 g/mol |
| SMILES | Oc1ccc(c(CC#N)c1)N(=O)=O |
| SPLASH | splash10-03fr-4900000000-f7fa3972f48aa8bd39eb |
| Source of Spectrum | F-53-4749-27 |
| Synonyms | 2-(5-hydroxy-2-nitro-phenyl)acetonitrile |
| Wiley ID | 801376 |