| SpectraBase Spectrum ID |
6P6CZUyFPjZ |
| Name |
2,3-Trans-2,4-cis-4-anilino-2-benzyl-3-phenyl-1,2,3,4-tetrahydroquinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
390.209598845 u |
| Formula |
C28H26N2 |
| InChI |
InChI=1S/C28H26N2/c1-4-12-21(13-5-1)20-26-27(22-14-6-2-7-15-22)28(29-23-16-8-3-9-17-23)24-18-10-11-19-25(24)30-26/h1-19,26-30H,20H2/t26-,27-,28-/m1/s1 |
| InChIKey |
LFCMWNZIEVTPHY-JCYYIGJDSA-N |
| Molecular Weight |
390.530 g/mol |
| SMILES |
[C@]1([C@@]([C@@](CC2=CC=CC=C2)(NC=2C1=CC=CC2)[H])(C1=CC=CC=C1)[H])(NC1=CC=CC=C1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963065 |
