SpectraBase Spectrum ID |
IuljsmWfjBN |
Name |
1,2-Naphthalenedione, 8-hydroxy-4-methoxy-; 8-hydroxy-4-methoxy-1,2-naphthoquinone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
204.042258734 u |
Formula |
C11H8O4 |
InChI |
InChI=1S/C11H8O4/c1-15-9-5-8(13)11(14)10-6(9)3-2-4-7(10)12/h2-5,12H,1H3 |
InChIKey |
NHFBHPPJZUCXBW-UHFFFAOYSA-N |
Molecular Weight |
204.181 g/mol |
SMILES |
OC1=CC=CC=2C(=CC(C(C12)=O)=O)OC |
Spectrum/Structure Validation Score (Raman) |
0.981235 |