SpectraBase Spectrum ID |
Foc07lEQas9 |
Name |
2-(Methyl(phenyl)amino)-3H-indol-3-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
236.094963013 u |
Formula |
C15H12N2O |
InChI |
InChI=1S/C15H12N2O/c1-17(11-7-3-2-4-8-11)15-14(18)12-9-5-6-10-13(12)16-15/h2-10H,1H3 |
InChIKey |
CAUPEZNIKSYQGV-UHFFFAOYSA-N |
Molecular Weight |
236.274 g/mol |
SMILES |
C1=2N=C(C(C2C=CC=C1)=O)N(C1=CC=CC=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.857406 |