| SpectraBase Spectrum ID |
2CXI3TsD8tB |
| Name |
7,7-Dimethyl-5,9,9-triphenyl-7,8-dihydro-9H-benzo[C]azepine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
401.214349873 u |
| Formula |
C30H27N |
| InChI |
InChI=1S/C30H27N/c1-29(2)20-27-26(23-12-6-3-7-13-23)18-19-31-21-28(27)30(22-29,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h3-21H,22H2,1-2H3 |
| InChIKey |
VFYDZNDBFBMBGC-UHFFFAOYSA-N |
| Molecular Weight |
401.553 g/mol |
| SMILES |
C1=2C(C(C3=CC=CC=C3)(C3=CC=CC=C3)CC(C2)(C)C)=CN=CC=C1C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864341 |
![7,7-Dimethyl-5,9,9-triphenyl-7,8-dihydro-9H-benzo[c]azepine](/api/spectrum/2CXI3TsD8tB/structure.png?h=300&w=458 "7,7-Dimethyl-5,9,9-triphenyl-7,8-dihydro-9H-benzo[c]azepine")
