SpectraBase Spectrum ID |
BaBONYDU3T2 |
Name |
4-Chloro-2'-hydroxy-5'-nitrochalcone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
303.029835502 u |
Formula |
C15H10ClNO4 |
InChI |
InChI=1S/C15H10ClNO4/c16-11-4-1-10(2-5-11)3-7-14(18)13-9-12(17(20)21)6-8-15(13)19/h1-9,19H |
InChIKey |
MVLWMRBSXZYPFZ-UHFFFAOYSA-N |
Molecular Weight |
303.701 g/mol |
SMILES |
OC=1C=CC(=CC1C(C=CC=1C=CC(=CC1)Cl)=O)N(=O)=O |
Spectrum/Structure Validation Score (Raman) |
0.968223 |