SpectraBase Spectrum ID |
njdHEYXWDf |
Name |
9,10-Dimethoxy-1-phenanthrenecarboxaldehyde |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
266.094294308 u |
Formula |
C17H14O3 |
InChI |
InChI=1S/C17H14O3/c1-19-16-14-8-4-3-7-12(14)13-9-5-6-11(10-18)15(13)17(16)20-2/h3-10H,1-2H3 |
InChIKey |
CAUSEOSOZGOALW-UHFFFAOYSA-N |
Molecular Weight |
266.296 g/mol |
SMILES |
C=1(C=CC=C2C3=CC=CC=C3C(=C(C12)OC)OC)C=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934412 |