SpectraBase Spectrum ID |
DwZcPruExtM |
Name |
2-Formyl-1,2,3,4-tetrahydro-1-phenylisoquinoline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
237.115364106 u |
Formula |
C16H15NO |
InChI |
InChI=1S/C16H15NO/c18-12-17-11-10-13-6-4-5-9-15(13)16(17)14-7-2-1-3-8-14/h1-9,12,16H,10-11H2 |
InChIKey |
BFAPKLZNAFBDPJ-UHFFFAOYSA-N |
Molecular Weight |
237.302 g/mol |
SMILES |
C1(N(CCC=2C=CC=CC12)C=O)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96264 |