SpectraBase Spectrum ID |
Dhbxfaf27Jb |
Name |
Phenacetic amide, 4-hydroxy-N-[2-[3,4-dimethoxyphenyl]ethyl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
315.147058156 u |
Formula |
C18H21NO4 |
InChI |
InChI=1S/C18H21NO4/c1-22-16-8-5-14(11-17(16)23-2)9-10-19-18(21)12-13-3-6-15(20)7-4-13/h3-8,11,20H,9-10,12H2,1-2H3,(H,19,21) |
InChIKey |
AFXJJRRNCJTPND-UHFFFAOYSA-N |
SMILES |
C1(OC)=C(OC)C=CC(=C1)CCNC(CC1=CC=C(O)C=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953607 |