| SpectraBase Spectrum ID |
cAzMdGxBh3 |
| Name |
(2S,4as,5S,8as)-2-Pentyl-5-propyldecahydroquinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
251.261300067 u |
| Formula |
C17H33N |
| InChI |
InChI=1S/C17H33N/c1-3-5-6-10-15-12-13-16-14(8-4-2)9-7-11-17(16)18-15/h14-18H,3-13H2,1-2H3 |
| InChIKey |
OMCPRMYYQXRJEA-UHFFFAOYSA-N |
| Molecular Weight |
251.458 g/mol |
| SMILES |
C1CCC2C(C1CCC)CCC(N2)CCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95075 |
