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9H-Xanthen-9-one, 2,4-dichloro-1,8-dihydroxy-5-methoxy-6-methyl-
SpectraBase Compound ID DmGH9dyN63b
InChI InChI=1S/C15H10Cl2O5/c1-5-3-8(18)9-12(20)10-11(19)6(16)4-7(17)14(10)22-15(9)13(5)21-2/h3-4,18-19H,1-2H3
InChIKey FCFXMZVGVGXWPY-UHFFFAOYSA-N
Mol Weight 341.15 g/mol
Molecular Formula C15H10Cl2O5
Exact Mass 339.990529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8E9xvxNCoDJ
Name 9H-Xanthen-9-one, 2,4-dichloro-1,8-dihydroxy-5-methoxy-6-methyl-
Alternate Name(s) 2,4-Dichloro-1,8-dihydroxy-5-methoxy-6-methyl-9H-xanthen-9-one Thiomelin
CAS Registry Number 113734-83-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H10Cl2O5
InChI InChI=1S/C15H10Cl2O5/c1-5-3-8(18)9-12(20)10-11(19)6(16)4-7(17)14(10)22-15(9)13(5)21-2/h3-4,18-19H,1-2H3
InChIKey FCFXMZVGVGXWPY-UHFFFAOYSA-N
Molecular Weight 341.146 g/mol
SMILES Oc1c(cc(c2c1C(c1c(cc(c(c1O2)OC)C)O)=O)Cl)Cl
SPLASH splash10-004l-0019000000-2601fc5358271bddbe64
Source of Spectrum B-40-1175-3
Wiley ID 1334876