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2-Anthracenecarboxylic acid, 9,10-dihydro-6-hydroxy-3,8-dimethoxy-1-methyl-9,10-dioxo-, methyl ester
SpectraBase Compound ID 6MC2n4Uf4n8
InChI InChI=1S/C19H16O7/c1-8-14-11(7-13(25-3)15(8)19(23)26-4)17(21)10-5-9(20)6-12(24-2)16(10)18(14)22/h5-7,20H,1-4H3
InChIKey QNXRGFHWFFPXDP-UHFFFAOYSA-N
Mol Weight 356.33 g/mol
Molecular Formula C19H16O7
Exact Mass 356.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GnNqhXFdVQb
Name 2-Anthracenecarboxylic acid, 9,10-dihydro-6-hydroxy-3,8-dimethoxy-1-methyl-9,10-dioxo-, methyl ester
Alternate Name(s) methyl 6-hydroxy-3,8-dimethoxy-1-methyl-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylate Methyl 6-hydroxy-3,8-dimethoxy-1-methylanthraquinone-2-carboxylate
CAS Registry Number 80750-97-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16O7
InChI InChI=1S/C19H16O7/c1-8-14-11(7-13(25-3)15(8)19(23)26-4)17(21)10-5-9(20)6-12(24-2)16(10)18(14)22/h5-7,20H,1-4H3
InChIKey QNXRGFHWFFPXDP-UHFFFAOYSA-N
Molecular Weight 356.330 g/mol
SMILES Oc1cc2C(c3c(C(c2c(c1)OC)=O)c(c(c(OC)c3)C(=O)OC)C)=O
SPLASH splash10-052f-0009000000-4df187e4729ae8f73af6
Source of Spectrum B-34-2415-0
Wiley ID 1345716