| SpectraBase Spectrum ID |
4CmwhistxVy |
| Name |
3,3-Dicyano-1.alpha.,2.beta.-diphenyl-1,2,3,10B-tetrahydro-isoquinolino[1,2-A]pyrrole |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
373.157897624 u |
| Formula |
C26H19N3 |
| InChI |
InChI=1S/C26H19N3/c27-17-26(18-28)24(21-12-5-2-6-13-21)23(20-10-3-1-4-11-20)25-22-14-8-7-9-19(22)15-16-29(25)26/h1-16,23-25H/t23-,24-,25?/m1/s1 |
| InChIKey |
WHKQZNQVYSYXJO-AEAWWFNXSA-N |
| Molecular Weight |
373.459 g/mol |
| SMILES |
C1(N2C([C@@]([C@]1(C1=CC=CC=C1)[H])(C=1C=CC=CC1)[H])C=1C=CC=CC1C=C2)(C#N)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935334 |
![3,3-Dicyano-1.alpha.,2.beta.-diphenyl-1,2,3,10b-tetrahydro-isoquinolino[1,2-a]pyrrole](/api/spectrum/4CmwhistxVy/structure.png?h=300&w=458 "3,3-Dicyano-1.alpha.,2.beta.-diphenyl-1,2,3,10b-tetrahydro-isoquinolino[1,2-a]pyrrole")
