SpectraBase Spectrum ID |
3JYTqaVTREq |
Name |
Acetamide, N-(3-nitrophenyl)-2-methoxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
210.064056806 u |
Formula |
C9H10N2O4 |
InChI |
InChI=1S/C9H10N2O4/c1-15-6-9(12)10-7-3-2-4-8(5-7)11(13)14/h2-5H,6H2,1H3,(H,10,12) |
InChIKey |
SDMUCJMMXQIJMS-UHFFFAOYSA-N |
Molecular Weight |
210.189 g/mol |
SMILES |
COCC(NC1=CC=CC(=C1)N(=O)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924165 |