| SpectraBase Spectrum ID |
53xUIxqfnnH |
| Name |
2-Iodo-6-(pyridin-2-yl)-6,6A,7,11B-tetrahydro-5H-indeno[2,1-C]quinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
424.043643555 u |
| Formula |
C21H17IN2 |
| InChI |
InChI=1S/C21H17IN2/c22-14-8-9-18-16(12-14)20-15-6-2-1-5-13(15)11-17(20)21(24-18)19-7-3-4-10-23-19/h1-10,12,17,20-21,24H,11H2 |
| InChIKey |
NGFBUAFPCPYOBV-UHFFFAOYSA-N |
| Molecular Weight |
424.285 g/mol |
| SMILES |
C12C(C(NC=3C2=CC(I)=CC3)C=2N=CC=CC2)CC2=C1C=CC=C2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895936 |
![2-Iodo-6-(pyridin-2-yl)-6,6a,7,11b-tetrahydro-5H-indeno[2,1-c]quinoline](/api/spectrum/53xUIxqfnnH/structure.png?h=300&w=458 "2-Iodo-6-(pyridin-2-yl)-6,6a,7,11b-tetrahydro-5H-indeno[2,1-c]quinoline")
