SpectraBase Spectrum ID |
2SJTtTx5kLI |
Name |
N-(2-Methoxy-5-methylphenyl)-2-phenylcyclopropanecarboxamide (isomer 2) |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
281.141578854 u |
Formula |
C18H19NO2 |
InChI |
InChI=1S/C18H19NO2/c1-12-8-9-17(21-2)16(10-12)19-18(20)15-11-14(15)13-6-4-3-5-7-13/h3-10,14-15H,11H2,1-2H3,(H,19,20) |
InChIKey |
ILWFNCDBGMJBKA-UHFFFAOYSA-N |
SMILES |
C1(NC(=O)C2C(C3=CC=CC=C3)C2)=C(C=CC(=C1)C)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826162 |