SpectraBase Spectrum ID |
B53abx5iWWW |
Name |
Pyridine, 1,2,3,6-tetrahydro-4-[3,4-dimethoxyphenyl]-1-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
233.141578854 u |
Formula |
C14H19NO2 |
InChI |
InChI=1S/C14H19NO2/c1-15-8-6-11(7-9-15)12-4-5-13(16-2)14(10-12)17-3/h4-6,10H,7-9H2,1-3H3 |
InChIKey |
UDSYPVISUVMBDO-UHFFFAOYSA-N |
Molecular Weight |
233.311 g/mol |
SMILES |
C1=CC(=C(C=C1C1=CCN(CC1)C)OC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924659 |