SpectraBase Spectrum ID |
L91NyvNx5aF |
Name |
2H-Indeno[1,2-D]pyrimidin-2-one, 1,3,4,5-tetrahydro-4-(2-pyridinyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
263.105862050 u |
Formula |
C16H13N3O |
InChI |
InChI=1S/C16H13N3O/c20-16-18-14-11-6-2-1-5-10(11)9-12(14)15(19-16)13-7-3-4-8-17-13/h1-8,15H,9H2,(H2,18,19,20) |
InChIKey |
XEAMRTHIQLMITC-UHFFFAOYSA-N |
Molecular Weight |
263.300 g/mol |
SMILES |
C1=C(N=CC=C1)C1C2=C(NC(N1)=O)C1=C(C=CC=C1)C2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921942 |