| SpectraBase Spectrum ID |
KvEqjC1VAkv |
| Name |
2-[(E)-(3-Methylbenzylidene)amino]isoindoline-1,3-quinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
264.089877632 u |
| Formula |
C16H12N2O2 |
| InChI |
InChI=1S/C16H12N2O2/c1-11-5-4-6-12(9-11)10-17-18-15(19)13-7-2-3-8-14(13)16(18)20/h2-10H,1H3/b17-10+ |
| InChIKey |
FEUSAJPRYXCNSK-LICLKQGHSA-N |
| Molecular Weight |
264.284 g/mol |
| SMILES |
C1(N(C(C2=CC=CC=C12)=O)\N=C\C=1C=C(C)C=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.950075 |
![2-[(E)-(3-methylbenzylidene)amino]isoindoline-1,3-quinone](/api/spectrum/KvEqjC1VAkv/structure.png?h=300&w=458 "2-[(E)-(3-methylbenzylidene)amino]isoindoline-1,3-quinone")
