SpectraBase Spectrum ID |
FZ1sNbjoik8 |
Name |
Quinoline, decahydro-4-chloro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
173.097127219 u |
Formula |
C9H16ClN |
InChI |
InChI=1S/C9H16ClN/c10-8-5-6-11-9-4-2-1-3-7(8)9/h7-9,11H,1-6H2/t7-,8+,9+/m0/s1 |
InChIKey |
ZWRZSBDOSLQQRX-DJLDLDEBSA-N |
Molecular Weight |
173.687 g/mol |
SMILES |
[C@@]12([C@](NCC[C@]2(Cl)[H])(CCCC1)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907635 |