SpectraBase Spectrum ID |
Bs0Ryhf2L9c |
Name |
1,2,3,6-Tetrahydropyridine, 1-acetyll-4-[4-acetoxy-5-methoxyphenyl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
289.131408092 u |
Formula |
C16H19NO4 |
InChI |
InChI=1S/C16H19NO4/c1-11(18)17-8-6-13(7-9-17)14-4-5-15(21-12(2)19)16(10-14)20-3/h4-6,10H,7-9H2,1-3H3 |
InChIKey |
DRYOTKMYLKQEEC-UHFFFAOYSA-N |
SMILES |
C1=C(C(=CC=C1C=1CCN(CC1)C(=O)C)OC(C)=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92944 |