| SpectraBase Spectrum ID |
606mAJtLrZs |
| Name |
Trans, trans-1-(m-nitrophenyl)-5-phenyl-1,4-pentadien-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
279.089543280 u |
| Formula |
C17H13NO3 |
| InChI |
InChI=1S/C17H13NO3/c19-17(11-9-14-5-2-1-3-6-14)12-10-15-7-4-8-16(13-15)18(20)21/h1-13H/b11-9+,12-10+ |
| InChIKey |
JFHFOSZIVUMHSZ-WGDLNXRISA-N |
| Molecular Weight |
279.295 g/mol |
| SMILES |
N(=O)(=O)C=1C=C(C=CC1)\C=C\C(\C=C\C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Raman) |
0.847426 |
