| SpectraBase Spectrum ID |
G8m1EqpncR |
| Name |
2H-Indol-2-one, 3-[(4-ethylphenyl)imino]-1,3-dihydro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
250.110613078 u |
| Formula |
C16H14N2O |
| InChI |
InChI=1S/C16H14N2O/c1-2-11-7-9-12(10-8-11)17-15-13-5-3-4-6-14(13)18-16(15)19/h3-10H,2H2,1H3,(H,17,18,19) |
| InChIKey |
KLXJWNOQOFPKJY-UHFFFAOYSA-N |
| Molecular Weight |
250.301 g/mol |
| SMILES |
C1(\C(C2=C(N1)C=CC=C2)=N\C1=CC=C(CC)C=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.867951 |