SpectraBase Spectrum ID |
8WHqLXyG45l |
Name |
2-Amino-3-phenylpropiophenone, hydrochloride |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
261.092041838 u |
Formula |
C15H16ClNO |
InChI |
InChI=1S/C15H15NO.ClH/c16-14(11-12-7-3-1-4-8-12)15(17)13-9-5-2-6-10-13;/h1-10,14H,11,16H2;1H |
InChIKey |
RJIOQTLGDPYPPH-UHFFFAOYSA-N |
Molecular Weight |
261.752 g/mol |
SMILES |
Cl.NC(C(C1=CC=CC=C1)=O)CC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Raman) |
0.991287 |