SpectraBase Spectrum ID |
4ZbtjxCHBid |
Name |
2-Phenylethanamine, 4'-benzyloxy-3'-hydroxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
243.125928789 u |
Formula |
C15H17NO2 |
InChI |
InChI=1S/C15H17NO2/c16-9-8-12-6-7-15(14(17)10-12)18-11-13-4-2-1-3-5-13/h1-7,10,17H,8-9,11,16H2 |
InChIKey |
VEOXVIUXSFRYTN-UHFFFAOYSA-N |
Molecular Weight |
243.306 g/mol |
SMILES |
C1(=C(C=C(C=C1)CCN)O)OCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.884172 |