SpectraBase Spectrum ID |
Dmwu9Y31bEr |
Name |
3-Benzylidene-1,1-dibenzylphthalan |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
388.182715392 u |
Formula |
C29H24O |
InChI |
InChI=1S/C29H24O/c1-4-12-23(13-5-1)20-28-26-18-10-11-19-27(26)29(30-28,21-24-14-6-2-7-15-24)22-25-16-8-3-9-17-25/h1-20H,21-22H2 |
InChIKey |
DJTNFLMQOIHFFL-UHFFFAOYSA-N |
Molecular Weight |
388.510 g/mol |
SMILES |
C=12C=CC=CC1C(OC2=CC=1C=CC=CC1)(CC=1C=CC=CC1)CC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Raman) |
0.964509 |