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9H-Xanthen-9-one, 1,3,6-tris(acetyloxy)-2,4,5-trichloro-8-methyl-
SpectraBase Compound ID 5qXCUQFm3ZK
InChI InChI=1S/C20H13Cl3O8/c1-6-5-10(28-7(2)24)13(21)17-11(6)16(27)12-18(29-8(3)25)14(22)20(30-9(4)26)15(23)19(12)31-17/h5H,1-4H3
InChIKey ZSFGCUUYUQLEQX-UHFFFAOYSA-N
Mol Weight 487.68 g/mol
Molecular Formula C20H13Cl3O8
Exact Mass 485.9676 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1wlwiPYGOT5
Name 9H-Xanthen-9-one, 1,3,6-tris(acetyloxy)-2,4,5-trichloro-8-methyl-
CAS Registry Number 69987-57-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H13Cl3O8
InChI InChI=1S/C20H13Cl3O8/c1-6-5-10(28-7(2)24)13(21)17-11(6)16(27)12-18(29-8(3)25)14(22)20(30-9(4)26)15(23)19(12)31-17/h5H,1-4H3
InChIKey ZSFGCUUYUQLEQX-UHFFFAOYSA-N
Molecular Weight 487.675 g/mol
SMILES c12c(Oc3c(C2=O)c(cc(OC(=O)C)c3Cl)C)c(Cl)c(c(c1OC(=O)C)Cl)OC(=O)C
SPLASH splash10-0f75-0001900000-a64e9570231f6df0fee6
Source of Spectrum F-34-2500-1
Synonyms 1,6-bis(acetyloxy)-2,4,5-trichloro-8-methyl-9-oxo-9H-xanthen-3-yl acetate 2,4,5-Trichloro-1,3,6-tri-O-acetylnorlichexanthon
Wiley ID 1396371