| SpectraBase Spectrum ID |
6V9Lh8nHqjc |
| Name |
(6R,6as,11Bs)-2-chloro-6-pyridin-2-yl-5,6A,7,11B-tetrahydro-6H-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 |
332.108026255 u |
| Formula |
C21H17ClN2 |
| InChI |
InChI=1S/C21H17ClN2/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/t17-,20-,21+/m0/s1 |
| InChIKey |
MUJCHKPFQFOWFW-DZFGPLHGSA-N |
| Molecular Weight |
332.834 g/mol |
| SMILES |
[C@]12([C@@]([C@@](C=3N=CC=CC3)([H])NC3=C1C=C(Cl)C=C3)(CC1=C2C=CC=C1)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91296 |
![(6R,6aS,11bS)-2-Chloro-6-pyridin-2-yl-5,6a,7,11b-tetrahydro-6H-indeno[2,1-c]quinoline](/api/spectrum/6V9Lh8nHqjc/structure.png?h=300&w=458 "(6R,6aS,11bS)-2-Chloro-6-pyridin-2-yl-5,6a,7,11b-tetrahydro-6H-indeno[2,1-c]quinoline")
