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9H-Xanthen-9-one, 2,4,5-trichloro-1,3,6-trimethoxy-8-methyl-
SpectraBase Compound ID BLJmYacbNdK
InChI InChI=1S/C17H13Cl3O5/c1-6-5-7(22-2)10(18)15-8(6)13(21)9-14(23-3)11(19)17(24-4)12(20)16(9)25-15/h5H,1-4H3
InChIKey WIWXESWGHSIZFN-UHFFFAOYSA-N
Mol Weight 403.65 g/mol
Molecular Formula C17H13Cl3O5
Exact Mass 401.982857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3CbSPcRgchc
Name 9H-Xanthen-9-one, 2,4,5-trichloro-1,3,6-trimethoxy-8-methyl-
CAS Registry Number 69987-56-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13Cl3O5
InChI InChI=1S/C17H13Cl3O5/c1-6-5-7(22-2)10(18)15-8(6)13(21)9-14(23-3)11(19)17(24-4)12(20)16(9)25-15/h5H,1-4H3
InChIKey WIWXESWGHSIZFN-UHFFFAOYSA-N
Molecular Weight 403.645 g/mol
SMILES c12c(Oc3c(C2=O)c(cc(OC)c3Cl)C)c(Cl)c(c(c1OC)Cl)OC
SPLASH splash10-0udi-0009200000-341a62cd4e88c88dfc38
Source of Spectrum F-34-2500-1
Synonyms 1,3,6-tri-O-methylarthothelin 2,4,5-Trichloro-1,3,6-tri-O-methylnorlichexanthone 2,4,5-Trichloro-1,3,6-trimethoxy-8-methyl-9H-xanthen-9-one
Wiley ID 1370184