SpectraBase Spectrum ID |
BeImj8piwfi |
Name |
10-(2-Methoxy-phenyl)-10,11-dihydro-5H-dibenzo[A,D]cycloheptene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
300.151415263 u |
Formula |
C22H20O |
InChI |
InChI=1S/C22H20O/c1-23-22-13-7-6-12-20(22)21-15-17-9-3-2-8-16(17)14-18-10-4-5-11-19(18)21/h2-13,21H,14-15H2,1H3 |
InChIKey |
JDDILNWWJXJDIL-UHFFFAOYSA-N |
SMILES |
C1(C2=C(CC3=C(C1)C=CC=C3)C=CC=C2)C1=C(OC)C=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.858821 |