| SpectraBase Spectrum ID |
DBqCp8yYKZg |
| Name |
1-Acetyl-3-phenyl-4A,9-dihydro-3H-2,3,9A-triazafluoren-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.116426733 u |
| Formula |
C18H15N3O2 |
| InChI |
InChI=1S/C18H15N3O2/c1-12(22)17-19-21(14-8-3-2-4-9-14)18(23)16-15-10-6-5-7-13(15)11-20(16)17/h2-10,16H,11H2,1H3 |
| InChIKey |
KIOUKWWDUATXIN-UHFFFAOYSA-N |
| Molecular Weight |
305.337 g/mol |
| SMILES |
C(=O)(C)C=1N2CC3=CC=CC=C3C2C(N(N1)C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946072 |
