SpectraBase Spectrum ID |
5xQwisypcea |
Name |
2,3-Dihydro-3-(p-hydroxybenzylidene)pyrrolo[2,1-B]quinazolin-9(1H)-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
290.105527697 u |
Formula |
C18H14N2O2 |
InChI |
InChI=1S/C18H14N2O2/c21-14-7-5-12(6-8-14)11-13-9-10-20-17(13)19-16-4-2-1-3-15(16)18(20)22/h1-8,11,21H,9-10H2 |
InChIKey |
FEXXRERBIUYJLC-UHFFFAOYSA-N |
Molecular Weight |
290.322 g/mol |
SMILES |
OC=1C=CC(=CC1)C=C1CCN2C(C=3C=CC=CC3N=C12)=O |
Spectrum/Structure Validation Score (Raman) |
0.869031 |