SpectraBase Spectrum ID |
J8l3ldnOa8C |
Name |
1-(bis-(4-Methoxyphenyl)-methylene)-1H-cyclopropa-[B]-naphthalene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
364.146329882 u |
Formula |
C26H20O2 |
InChI |
InChI=1S/C26H20O2/c1-27-21-11-7-17(8-12-21)25(18-9-13-22(28-2)14-10-18)26-23-15-19-5-3-4-6-20(19)16-24(23)26/h3-16H,1-2H3 |
InChIKey |
XPNOWFUHASGTAY-UHFFFAOYSA-N |
Molecular Weight |
364.444 g/mol |
SMILES |
C1(OC)=CC=C(C(=C2C3=CC=4C=CC=CC4C=C23)C2=CC=C(OC)C=C2)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939422 |