SpectraBase Spectrum ID |
3RCtDcF0TuT |
Name |
[2,2'-Binaphthalene]-1,4-dione, 1'-hydroxy-4'-methoxy- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
330.089208927 u |
Formula |
C21H14O4 |
InChI |
InChI=1S/C21H14O4/c1-25-19-11-17(21(24)15-9-5-3-7-13(15)19)16-10-18(22)12-6-2-4-8-14(12)20(16)23/h2-11,24H,1H3 |
InChIKey |
JTDIJHBEBMBAAM-UHFFFAOYSA-N |
Molecular Weight |
330.339 g/mol |
SMILES |
C=1(C=2C(=C3C=CC=CC3=C(C2)OC)O)C(C=2C=CC=CC2C(C1)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.907378 |