SpectraBase Spectrum ID |
4oxZ4reJcdf |
Name |
2,2'-bi(3-Hydroxy-1,4-naphthoquinone) |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
346.047738036 u |
Formula |
C20H10O6 |
InChI |
InChI=1S/C20H10O6/c21-15-9-5-1-3-7-11(9)17(23)19(25)13(15)14-16(22)10-6-2-4-8-12(10)18(24)20(14)26/h1-8,25-26H |
InChIKey |
ISTBADQWZSTTOA-UHFFFAOYSA-N |
Molecular Weight |
346.294 g/mol |
SMILES |
C1(C2=C(C(=O)C3=C(C2=O)C=CC=C3)O)=C(C(C2=CC=CC=C2C1=O)=O)O |
Spectrum/Structure Validation Score (Raman) |
0.964558 |