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9H-Xanthen-9-one, 2,7-dichloro-1,3,6-trihydroxy-8-methyl-
SpectraBase Compound ID 34OeiFZrmDb
InChI InChI=1S/C14H8Cl2O5/c1-4-9-7(2-5(17)11(4)15)21-8-3-6(18)12(16)14(20)10(8)13(9)19/h2-3,17-18,20H,1H3
InChIKey PNDZPHQVTKKLAZ-UHFFFAOYSA-N
Mol Weight 327.12 g/mol
Molecular Formula C14H8Cl2O5
Exact Mass 325.974879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IekflfFRpDN
Name 9H-Xanthen-9-one, 2,7-dichloro-1,3,6-trihydroxy-8-methyl-
CAS Registry Number 22346-57-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8Cl2O5
InChI InChI=1S/C14H8Cl2O5/c1-4-9-7(2-5(17)11(4)15)21-8-3-6(18)12(16)14(20)10(8)13(9)19/h2-3,17-18,20H,1H3
InChIKey PNDZPHQVTKKLAZ-UHFFFAOYSA-N
Molecular Weight 327.119 g/mol
SMILES Oc1cc2Oc3cc(c(c(c3C(c2c(c1Cl)O)=O)C)Cl)O
SPLASH splash10-0006-9065000000-cc1aba24247bf5ef93f0
Source of Spectrum B-43-1754-16
Synonyms 2,7-Dichloro-1,3,6-trihydroxy-8-methyl-9-xanthenone 2,7-Dichloro-1,3,6-trihydroxy-8-methylxanthen-9-one 2,7-Dichloro-1,3,6-trihydroxy-8-methyl-xanthen-9-one 2,7-bis(chloranyl)-1-methyl-3,6,8-tris(oxidanyl)xanthen-9-one
Wiley ID 1324421