SpectraBase Spectrum ID |
DwWPc1zC24Z |
Name |
Acetamide, N-(3-nitrophenyl)-2-acetoxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
238.058971425 u |
Formula |
C10H10N2O5 |
InChI |
InChI=1S/C10H10N2O5/c1-7(13)17-6-10(14)11-8-3-2-4-9(5-8)12(15)16/h2-5H,6H2,1H3,(H,11,14) |
InChIKey |
FXPSKSZDZMYNHZ-UHFFFAOYSA-N |
Molecular Weight |
238.199 g/mol |
SMILES |
CC(OCC(NC1=CC=CC(=C1)N(=O)=O)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975755 |