SpectraBase Compound ID | B0NeEPQxTby |
---|---|
InChI | InChI=1S/C13H10O4/c1-7-10(6-11(14)15)13(17)9-5-3-2-4-8(9)12(7)16/h2-5H,6H2,1H3,(H,14,15) |
InChIKey | VPKOPDWUJDQYLF-UHFFFAOYSA-N |
Mol Weight | 230.22 g/mol |
Molecular Formula | C13H10O4 |
Exact Mass | 230.057909 g/mol |
SpectraBase Spectrum ID | Fh2gireCMaO |
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Name | (3-Methyl-1,4-dioxo-1,4-dihydro-2-naphthyl)acetic acid |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 230.057908798 u |
Formula | C13H10O4 |
InChI | InChI=1S/C13H10O4/c1-7-10(6-11(14)15)13(17)9-5-3-2-4-8(9)12(7)16/h2-5H,6H2,1H3,(H,14,15) |
InChIKey | VPKOPDWUJDQYLF-UHFFFAOYSA-N |
Molecular Weight | 230.219 g/mol |
SMILES | C12=C(C=CC=C2)C(C(=C(C1=O)C)CC(O)=O)=O |