| SpectraBase Spectrum ID |
4Np7KAk669K |
| Name |
2-Benzyl-5,6-dimethyl-1,1,3,3-tetraethylisoindoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.276950131 u |
| Formula |
C25H35N |
| InChI |
InChI=1S/C25H35N/c1-7-24(8-2)22-16-19(5)20(6)17-23(22)25(9-3,10-4)26(24)18-21-14-12-11-13-15-21/h11-17H,7-10,18H2,1-6H3 |
| InChIKey |
ILYRJPZTOUNIEI-UHFFFAOYSA-N |
| Molecular Weight |
349.562 g/mol |
| SMILES |
C1(N(C(C=2C=C(C(=CC12)C)C)(CC)CC)CC=1C=CC=CC1)(CC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.866887 |
