| SpectraBase Spectrum ID |
IACEnFsgEsq |
| Name |
(2-Nitrophenyl) 2-phenoxyacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
273.063722453 u |
| Formula |
C14H11NO5 |
| InChI |
InChI=1S/C14H11NO5/c16-14(10-19-11-6-2-1-3-7-11)20-13-9-5-4-8-12(13)15(17)18/h1-9H,10H2 |
| InChIKey |
MCLKDMAJJCTWGD-UHFFFAOYSA-N |
| Molecular Weight |
273.244 g/mol |
| SMILES |
C=1(N(=O)=O)C(OC(=O)COC2=CC=CC=C2)=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960792 |
