| SpectraBase Spectrum ID |
KeHXFynPZL4 |
| Name |
(1,2-Dimethyl-1,2-dihydrocinnolin-3-yl)(4-bromophenyl)methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.036776110 u |
| Formula |
C17H15BrN2O |
| InChI |
InChI=1S/C17H15BrN2O/c1-19-15-6-4-3-5-13(15)11-16(20(19)2)17(21)12-7-9-14(18)10-8-12/h3-11H,1-2H3 |
| InChIKey |
AYNRMGVMNOCNMY-UHFFFAOYSA-N |
| Molecular Weight |
343.224 g/mol |
| SMILES |
C=1(N(N(C)C2=C(C1)C=CC=C2)C)C(C=1C=CC(=CC1)Br)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914264 |
