SpectraBase Spectrum ID |
6Iz1gB1FpEw |
Name |
1,4-bis(2-Formylphenoxymethyl)benzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
346.120509056 u |
Formula |
C22H18O4 |
InChI |
InChI=1S/C22H18O4/c23-13-19-5-1-3-7-21(19)25-15-17-9-11-18(12-10-17)16-26-22-8-4-2-6-20(22)14-24/h1-14H,15-16H2 |
InChIKey |
NQXOMFZMVUNARI-UHFFFAOYSA-N |
Molecular Weight |
346.382 g/mol |
SMILES |
C=1(C(OCC=2C=CC(COC=3C(C=O)=CC=CC3)=CC2)=CC=CC1)C=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936603 |