| SpectraBase Compound ID | 4pyr1VOCINE |
|---|---|
| InChI | InChI=1S/C8H6N2O2/c1-2-6-5-7(10(11)12)3-4-8(6)9/h1,3-5H,9H2 |
| InChIKey | AOFBHHWRKCIHLV-UHFFFAOYSA-N |
| Mol Weight | 162.15 g/mol |
| Molecular Formula | C8H6N2O2 |
| Exact Mass | 162.042927 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1XwDh0Tp0y |
|---|---|
| Name | 4-Nitro-2-ethynylaniline |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H6N2O2 |
| InChI | InChI=1S/C8H6N2O2/c1-2-6-5-7(10(11)12)3-4-8(6)9/h1,3-5H,9H2 |
| InChIKey | AOFBHHWRKCIHLV-UHFFFAOYSA-N |
| Molecular Weight | 162.148 g/mol |
| SMILES | Nc1ccc(N(=O)=O)cc1C#C |
| SPLASH | splash10-03dr-8900000000-371a005a560f68aeb6fc |
| Source of Spectrum | F4-44-3290-1d |
| Synonyms | 2-Ethynyl-4-nitroaniline 2-Ethynyl-4-nitro-aniline |
| Wiley ID | 1736795 |