| SpectraBase Spectrum ID |
LijR361Ran4 |
| Name |
2-(4-Methoxyphenyl)-1-(phenylethynyl)-1,2,3,4-tetrahydroisoquinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.162314299 u |
| Formula |
C24H21NO |
| InChI |
InChI=1S/C24H21NO/c1-26-22-14-12-21(13-15-22)25-18-17-20-9-5-6-10-23(20)24(25)16-11-19-7-3-2-4-8-19/h2-10,12-15,24H,17-18H2,1H3 |
| InChIKey |
ZLCXOTJSWFHZDZ-UHFFFAOYSA-N |
| Molecular Weight |
339.438 g/mol |
| SMILES |
C1(N(CCC=2C=CC=CC12)C=1C=CC(=CC1)OC)C#CC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.886882 |
