SpectraBase Spectrum ID |
EjhkcF1AKmc |
Name |
(+-)-6-phenyl-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
235.136099551 u |
Formula |
C17H17N |
InChI |
InChI=1S/C17H17N/c1-2-5-13(6-3-1)15-10-12-18-11-9-14-7-4-8-16(15)17(14)18/h1-8,15H,9-12H2 |
InChIKey |
YHLPNDUNPITGNF-UHFFFAOYSA-N |
Molecular Weight |
235.330 g/mol |
SMILES |
C1N2C=3C(=CC=CC3C(C1)C=1C=CC=CC1)CC2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907604 |