| SpectraBase Compound ID | C7oTgUNKsyD |
|---|---|
| InChI | InChI=1S/C16H11NO2/c18-17(19)16-12-10-15(11-13-16)9-5-4-8-14-6-2-1-3-7-14/h1-4,6-8,10-13H/b8-4+ |
| InChIKey | OFDAEJBPQOUTLK-XBXARRHUSA-N |
| Mol Weight | 249.27 g/mol |
| Molecular Formula | C16H11NO2 |
| Exact Mass | 249.078979 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | wOvdiSINFG |
|---|---|
| Name | 1-Nitro-4-[(E)-4-phenylbut-3-en-1-ynyl]benzene |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H11NO2 |
| InChI | InChI=1S/C16H11NO2/c18-17(19)16-12-10-15(11-13-16)9-5-4-8-14-6-2-1-3-7-14/h1-4,6-8,10-13H/b8-4+ |
| InChIKey | OFDAEJBPQOUTLK-XBXARRHUSA-N |
| Molecular Weight | 249.269 g/mol |
| SMILES | C(\C=C\c1ccccc1)#Cc1ccc(cc1)N(=O)=O |
| SPLASH | splash10-0f8i-9280000000-97acb36e231bb666e89f |
| Source of Spectrum | KC-0-2479-12 |
| Wiley ID | 781998 |