| SpectraBase Spectrum ID |
DXClFIBuMMZ |
| Name |
7-Methylisoindolo[1,2-B]quinazolin-10(12H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.094963013 u |
| Formula |
C16H12N2O |
| InChI |
InChI=1S/C16H12N2O/c1-10-6-7-13-14(8-10)17-15-12-5-3-2-4-11(12)9-18(15)16(13)19/h2-8H,9H2,1H3 |
| InChIKey |
OFWOCMPYABXGHR-UHFFFAOYSA-N |
| Molecular Weight |
248.285 g/mol |
| SMILES |
C12=NC3=C(C(N2CC2=C1C=CC=C2)=O)C=CC(=C3)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931555 |