SpectraBase Spectrum ID |
7E1KeSD8RjG |
Name |
2-[(E)-2-(2,5-Dipropoxyphenyl)ethenyl]benzene-1,4-diol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
328.167459249 u |
Formula |
C20H24O4 |
InChI |
InChI=1S/C20H24O4/c1-3-11-23-18-8-10-20(24-12-4-2)16(14-18)6-5-15-13-17(21)7-9-19(15)22/h5-10,13-14,21-22H,3-4,11-12H2,1-2H3/b6-5+ |
InChIKey |
JHUMSXVTQGXTKO-AATRIKPKSA-N |
Molecular Weight |
328.408 g/mol |
SMILES |
C=1(\C=C\C=2C(=CC=C(C2)O)O)C(=CC=C(C1)OCCC)OCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933835 |