SpectraBase Spectrum ID |
Clum7Q9Lbsx |
Name |
1-(1-(2,5-Dimethoxyphenyl)-2-methylpropyl)-2,3,4-trimethoxybenzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
360.193673997 u |
Formula |
C21H28O5 |
InChI |
InChI=1S/C21H28O5/c1-13(2)19(16-12-14(22-3)8-10-17(16)23-4)15-9-11-18(24-5)21(26-7)20(15)25-6/h8-13,19H,1-7H3 |
InChIKey |
JFAWNSRCUCIZDL-UHFFFAOYSA-N |
Molecular Weight |
360.450 g/mol |
SMILES |
C1(=C(C(=CC=C1OC)C(C1=C(C=CC(=C1)OC)OC)C(C)C)OC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91239 |