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3-Chloro-benzoic acid 1-(4-benzyloxy-3-methoxy-phenyl)-2,3-dihydroxy-propyl ester
SpectraBase Compound ID 9BfWNCMB2uU
InChI InChI=1S/C24H23ClO6/c1-29-22-13-17(10-11-21(22)30-15-16-6-3-2-4-7-16)23(20(27)14-26)31-24(28)18-8-5-9-19(25)12-18/h2-13,20,23,26-27H,14-15H2,1H3
InChIKey RADNYVZXIRFMLJ-UHFFFAOYSA-N
Mol Weight 442.9 g/mol
Molecular Formula C24H23ClO6
Exact Mass 442.118316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jlY5CgYkIr
Name 3-Chloro-benzoic acid 1-(4-benzyloxy-3-methoxy-phenyl)-2,3-dihydroxy-propyl ester
Alternate Name(s) 1-[4-(benzyloxy)-3-methoxyphenyl]-2,3-dihydroxypropyl 3-chlorobenzoate 5-[(3''-Chlorobenzoyl)oxy]-1-(4'-benzyloxy-3'-methoxyphenyl)-1,2,3-propanetriol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23ClO6
InChI InChI=1S/C24H23ClO6/c1-29-22-13-17(10-11-21(22)30-15-16-6-3-2-4-7-16)23(20(27)14-26)31-24(28)18-8-5-9-19(25)12-18/h2-13,20,23,26-27H,14-15H2,1H3
InChIKey RADNYVZXIRFMLJ-UHFFFAOYSA-N
Molecular Weight 442.895 g/mol
SMILES OC(CO)C(OC(c1cc(Cl)ccc1)=O)c1cc(OC)c(cc1)OCc1ccccc1
SPLASH splash10-0006-9410000000-775a48574a95007eb6dc
Source of Spectrum SK-32-561-5
Wiley ID 1548590