| SpectraBase Spectrum ID |
En5YJa0sZst |
| Name |
(2S,3S)-3-(2-Methoxybenzylamino)-2-phenylpiperidine, N,N'-dimethyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.220163529 u |
| Formula |
C21H28N2O |
| InChI |
InChI=1S/C21H28N2O/c1-22-15-9-13-19(21(22)17-10-5-4-6-11-17)23(2)16-18-12-7-8-14-20(18)24-3/h4-8,10-12,14,19,21H,9,13,15-16H2,1-3H3/t19-,21-/m0/s1 |
| InChIKey |
ZBDQBCNPYMKHTC-FPOVZHCZSA-N |
| Molecular Weight |
324.468 g/mol |
| SMILES |
C1(CN(C)[C@]2(CCCN(C)[C@]2(C2=CC=CC=C2)[H])[H])=C(C=CC=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.829216 |
