| SpectraBase Spectrum ID |
F1WgD9NS9uS |
| Name |
1,4-Naphthalenedione, 3-[(1,4-dihydro-5-hydroxy-1,4-dioxo-2-naphthalenyl)methyl]-5-hydroxy- 2-methyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
374.079038165 u |
| Formula |
C22H14O6 |
| InChI |
InChI=1S/C22H14O6/c1-10-14(22(28)19-13(20(10)26)5-3-7-16(19)24)8-11-9-17(25)18-12(21(11)27)4-2-6-15(18)23/h2-7,9,23-24H,8H2,1H3 |
| InChIKey |
CEBZDZOZLNOOFL-UHFFFAOYSA-N |
| Molecular Weight |
374.348 g/mol |
| SMILES |
C=1(C(C=2C(O)=CC=CC2C(C1C)=O)=O)CC=1C(C=2C=CC=C(C2C(C1)=O)O)=O |
![1,4-Naphthalenedione, 3-[(1,4-dihydro-5-hydroxy-1,4-dioxo-2-naphthalenyl)methyl]-5-hydroxy- 2-methyl-](/api/spectrum/F1WgD9NS9uS/structure.png?h=300&w=458 "1,4-Naphthalenedione, 3-[(1,4-dihydro-5-hydroxy-1,4-dioxo-2-naphthalenyl)methyl]-5-hydroxy- 2-methyl-")
