SpectraBase Spectrum ID |
BEX0AdX2qc1 |
Name |
Benzophenone, 4,4'-methylenebis- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
376.146329882 u |
Formula |
C27H20O2 |
InChI |
InChI=1S/C27H20O2/c28-26(22-7-3-1-4-8-22)24-15-11-20(12-16-24)19-21-13-17-25(18-14-21)27(29)23-9-5-2-6-10-23/h1-18H,19H2 |
InChIKey |
IAZJTHIZDCKMKL-UHFFFAOYSA-N |
Molecular Weight |
376.455 g/mol |
SMILES |
C1=C(C=CC=C1)C(=O)C1=CC=C(C=C1)CC1=CC=C(C=C1)C(=O)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901934 |