SpectraBase Spectrum ID |
8djGyP1uz7l |
Name |
1,3,3,5,5-Pentamethyl-2,3,4,5-tetrahydro-1H-benzo[C]azepine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
217.183049745 u |
Formula |
C15H23N |
InChI |
InChI=1S/C15H23N/c1-11-12-8-6-7-9-13(12)14(2,3)10-15(4,5)16-11/h6-9,11,16H,10H2,1-5H3 |
InChIKey |
RQBRKGKGRPCILJ-UHFFFAOYSA-N |
Molecular Weight |
217.356 g/mol |
SMILES |
C1=CC=C2C(=C1)C(C)(CC(NC2C)(C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953274 |