SpectraBase Spectrum ID |
HYF9OI9cmTW |
Name |
2-((2S,4R,9as)-Octahydro-2-methyl-6-oxo-1hquinolizin-4-yl)acetaldehyde |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
209.141578854 u |
Formula |
C12H19NO2 |
InChI |
InChI=1S/C12H19NO2/c1-9-7-10-3-2-4-12(15)13(10)11(8-9)5-6-14/h6,9-11H,2-5,7-8H2,1H3/t9-,10-,11-/m0/s1 |
InChIKey |
NIWJUBURGFUNIQ-DCAQKATOSA-N |
Molecular Weight |
209.289 g/mol |
SMILES |
[C@@]1(N2[C@](C[C@@](C1)(C)[H])(CCCC2=O)[H])(CC=O)[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.981512 |