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4-(4-Chlorobenzoyl)-3-hydroxy-5-[(4-chlorobenzoyl)methyl]-5-(methoxycarbonyl)-2,5-dihydrofuran-2-one
SpectraBase Compound ID Gfk3kkvrygs
InChI InChI=1S/C21H14Cl2O7/c1-29-20(28)21(10-15(24)11-2-6-13(22)7-3-11)16(18(26)19(27)30-21)17(25)12-4-8-14(23)9-5-12/h2-9,26H,10H2,1H3
InChIKey BUTLMSOCTFVFLX-UHFFFAOYSA-N
Mol Weight 449.24 g/mol
Molecular Formula C21H14Cl2O7
Exact Mass 448.011658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2U2rBl91bbU
Name 4-(4-Chlorobenzoyl)-3-hydroxy-5-[(4-chlorobenzoyl)methyl]-5-(methoxycarbonyl)-2,5-dihydrofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H14Cl2O7
InChI InChI=1S/C21H14Cl2O7/c1-29-20(28)21(10-15(24)11-2-6-13(22)7-3-11)16(18(26)19(27)30-21)17(25)12-4-8-14(23)9-5-12/h2-9,26H,10H2,1H3
InChIKey BUTLMSOCTFVFLX-UHFFFAOYSA-N
Molecular Weight 449.242 g/mol
SMILES OC1=C(C(OC1=O)(CC(c1ccc(cc1)Cl)=O)C(=O)OC)C(c1ccc(cc1)Cl)=O
SPLASH splash10-01p9-1900000000-5cf3ec9615c24f184801
Source of Spectrum QB-20-1376-3
Synonyms 4-(4-Chlorobenzoyl)-3-hydroxy-5-[(4-chlorobenzoyl)methyl]-5-(methoxycarbonyl)dihydrofuran-2-one Methyl 3-(4-chlorobenzoyl)-2-[2-(4-chlorophenyl)-2-oxoethyl]-4-hydroxy-5-oxo-2,5-dihydro-2-furancarboxylate
Wiley ID 860399