| SpectraBase Spectrum ID |
GtFF2Z6unKE |
| Name |
Trans-cinnamic acid, 2-chloro-4-nitrophenyl ester |
| 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/c16-13-10-12(17(19)20)7-8-14(13)21-15(18)9-6-11-4-2-1-3-5-11/h1-10H/b9-6+ |
| InChIKey |
FSHFMYVXLRMKTN-RMKNXTFCSA-N |
| SMILES |
N(=O)(=O)C1=CC=C(C(=C1)Cl)OC(\C=C\C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Raman) |
0.726273 |
