| SpectraBase Spectrum ID |
HsfmuUkPpdk |
| Name |
7-Methoxy-6-methyl-2,5,8-trihydroxy-1,4-naphthoquinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
250.047738036 u |
| Formula |
C12H10O6 |
| InChI |
InChI=1S/C12H10O6/c1-4-9(15)7-5(13)3-6(14)10(16)8(7)11(17)12(4)18-2/h3,14-15,17H,1-2H3 |
| InChIKey |
LOAIGMHHGBQOQB-UHFFFAOYSA-N |
| Molecular Weight |
250.206 g/mol |
| SMILES |
C1(C(=CC(C=2C(=C(C(=C(C12)O)OC)C)O)=O)O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864691 |
