SpectraBase Spectrum ID |
HUYGNLVb6EA |
Name |
N-Ethyl-2-methoxy-5-nitrobenzylamine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
210.100442316 u |
Formula |
C10H14N2O3 |
InChI |
InChI=1S/C10H14N2O3/c1-3-11-7-8-6-9(12(13)14)4-5-10(8)15-2/h4-6,11H,3,7H2,1-2H3 |
InChIKey |
RSRBCKRCAGDWQU-UHFFFAOYSA-N |
Molecular Weight |
210.233 g/mol |
SMILES |
C1=CC(OC)=C(C=C1N(=O)=O)CNCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936956 |