SpectraBase Spectrum ID |
DwI0hon9Yzp |
Name |
2-Imidazoline-2-carboxamide, N-(4-methoxyphenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
219.100776669 u |
Formula |
C11H13N3O2 |
InChI |
InChI=1S/C11H13N3O2/c1-16-9-4-2-8(3-5-9)14-11(15)10-12-6-7-13-10/h2-5H,6-7H2,1H3,(H,12,13)(H,14,15) |
InChIKey |
KTBPJUXKUAVHGU-UHFFFAOYSA-N |
Molecular Weight |
219.244 g/mol |
SMILES |
C1NC(C(NC2=CC=C(C=C2)OC)=O)=NC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879883 |