SpectraBase Spectrum ID |
AjDrBXkOBIV |
Name |
9-Methyl-9-phenyl-9,10-dihydrophenanthrene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
270.140850580 u |
Formula |
C21H18 |
InChI |
InChI=1S/C21H18/c1-21(17-10-3-2-4-11-17)15-16-9-5-6-12-18(16)19-13-7-8-14-20(19)21/h2-14H,15H2,1H3 |
InChIKey |
PTQCIWFGFNLFMD-UHFFFAOYSA-N |
Molecular Weight |
270.375 g/mol |
SMILES |
C1(C2=C(C=CC=C2)C2=C(C1)C=CC=C2)(C1=CC=CC=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898417 |