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2-Anthracenecarboxylic acid, 9,10-dihydro-6,8-dihydroxy-3-methoxy-1-methyl-9,10-dioxo-, methyl ester
SpectraBase Compound ID CmPnV4V8eAc
InChI InChI=1S/C18H14O7/c1-7-13-10(6-12(24-2)14(7)18(23)25-3)16(21)9-4-8(19)5-11(20)15(9)17(13)22/h4-6,19-20H,1-3H3
InChIKey MGRGQCPZIQHBGB-UHFFFAOYSA-N
Mol Weight 342.3 g/mol
Molecular Formula C18H14O7
Exact Mass 342.073953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1O1fHYmyheS
Name 2-Anthracenecarboxylic acid, 9,10-dihydro-6,8-dihydroxy-3-methoxy-1-methyl-9,10-dioxo-, methyl ester
Alternate Name(s) methyl 6,8-dihydroxy-3-methoxy-1-methyl-9,10-dioxo-9,10-dihydro-2-anthracenecarboxylate Methyl 6,8-dihydroxy-3-methoxy-1-methylanthraquinone-2-carboxylate
CAS Registry Number 80750-98-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14O7
InChI InChI=1S/C18H14O7/c1-7-13-10(6-12(24-2)14(7)18(23)25-3)16(21)9-4-8(19)5-11(20)15(9)17(13)22/h4-6,19-20H,1-3H3
InChIKey MGRGQCPZIQHBGB-UHFFFAOYSA-N
Molecular Weight 342.303 g/mol
SMILES Oc1cc2C(c3c(C(c2c(c1)O)=O)c(c(c(c3)OC)C(=O)OC)C)=O
SPLASH splash10-004l-0009000000-2548f2bf795d77c39adb
Source of Spectrum B-34-2415-0
Wiley ID 1336421