| SpectraBase Spectrum ID |
K84zWXus6iE |
| Name |
2-m-Tolyl-1,2-dihydrobenzo[G]indazol-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
274.110613078 u |
| Formula |
C18H14N2O |
| InChI |
InChI=1S/C18H14N2O/c1-12-5-4-7-14(11-12)20-18(21)16-10-9-13-6-2-3-8-15(13)17(16)19-20/h2-11,19H,1H3 |
| InChIKey |
ZAZSLOVUCSHBQB-UHFFFAOYSA-N |
| SMILES |
C1=C2C=CC=3C(=O)N(NC3C2=CC=C1)C1=CC(C)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817265 |