| SpectraBase Spectrum ID |
tJtWFLG9wE |
| Name |
(2R,5R)-2-Amyl-5-butyl-pyrrolidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
197.214349873 u |
| Formula |
C13H27N |
| InChI |
InChI=1S/C13H27N/c1-3-5-7-9-13-11-10-12(14-13)8-6-4-2/h12-14H,3-11H2,1-2H3/t12-,13-/m1/s1 |
| InChIKey |
CAMNFGRSYHBOEL-CHWSQXEVSA-N |
| Molecular Weight |
197.366 g/mol |
| SMILES |
[C@]1(N[C@@](CC1)(CCCCC)[H])(CCCC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.975884 |
