| SpectraBase Spectrum ID |
6DbgLXOy2Di |
| Name |
N-Benzyl-3-[1'-(2'-hydroxy-3'-methylbutyl)]pyrrolidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
247.193614428 u |
| Formula |
C16H25NO |
| InChI |
InChI=1S/C16H25NO/c1-13(2)16(18)10-15-8-9-17(12-15)11-14-6-4-3-5-7-14/h3-7,13,15-16,18H,8-12H2,1-2H3 |
| InChIKey |
QBUXPGZTKPGZGB-UHFFFAOYSA-N |
| Molecular Weight |
247.382 g/mol |
| SMILES |
C1N(CCC1CC(C(C)C)O)CC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864938 |
![N-Benzyl-3-[1'-(2'-hydroxy-3'-methylbutyl)]pyrrolidine](/api/spectrum/6DbgLXOy2Di/structure.png?h=300&w=458 "N-Benzyl-3-[1'-(2'-hydroxy-3'-methylbutyl)]pyrrolidine")
