SpectraBase Spectrum ID |
7JTPlcQzOmr |
Name |
Phenethanamine, 4-hydroxy-3-methoxy-N-phenacetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
285.136493473 u |
Formula |
C17H19NO3 |
InChI |
InChI=1S/C17H19NO3/c1-21-16-11-14(7-8-15(16)19)9-10-18-17(20)12-13-5-3-2-4-6-13/h2-8,11,19H,9-10,12H2,1H3,(H,18,20) |
InChIKey |
YXGKTGCZLBXGGD-UHFFFAOYSA-N |
SMILES |
C1(=C(C=C(C=C1)CCNC(CC1=CC=CC=C1)=O)OC)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.828996 |