SpectraBase Spectrum ID |
Grt8hUzNMkY |
Name |
N-Benzyl-3-[1'-(2'-hydroxy-2',2'-diphenyl)ethyl]pyrrolidine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
357.209264492 u |
Formula |
C25H27NO |
InChI |
InChI=1S/C25H27NO/c27-25(23-12-6-2-7-13-23,24-14-8-3-9-15-24)18-22-16-17-26(20-22)19-21-10-4-1-5-11-21/h1-15,22,27H,16-20H2 |
InChIKey |
HCVFHWVEYZNBDR-UHFFFAOYSA-N |
Molecular Weight |
357.497 g/mol |
SMILES |
C(CC1CN(CC2=CC=CC=C2)CC1)(C1=CC=CC=C1)(C1=CC=CC=C1)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900057 |