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Benzyl 3-Chloro-4-(3'-chloro-2'-hydroxy-4'-methoxy-6'-methylbenzoyloxy)-2,6-dihydroxybenzoate
SpectraBase Compound ID BJjuiAprorY
InChI InChI=1S/C23H18Cl2O8/c1-11-8-14(31-2)18(24)20(27)16(11)23(30)33-15-9-13(26)17(21(28)19(15)25)22(29)32-10-12-6-4-3-5-7-12/h3-9,26-28H,10H2,1-2H3
InChIKey KVXUHORIHHDQFA-UHFFFAOYSA-N
Mol Weight 493.3 g/mol
Molecular Formula C23H18Cl2O8
Exact Mass 492.037873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ij68vusB6R1
Name Benzyl 3-Chloro-4-(3'-chloro-2'-hydroxy-4'-methoxy-6'-methylbenzoyloxy)-2,6-dihydroxybenzoate
Alternate Name(s) 4-[(benzyloxy)carbonyl]-2-chloro-3,5-dihydroxyphenyl 3-chloro-2-hydroxy-4-methoxy-6-methylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18Cl2O8
InChI InChI=1S/C23H18Cl2O8/c1-11-8-14(31-2)18(24)20(27)16(11)23(30)33-15-9-13(26)17(21(28)19(15)25)22(29)32-10-12-6-4-3-5-7-12/h3-9,26-28H,10H2,1-2H3
InChIKey KVXUHORIHHDQFA-UHFFFAOYSA-N
Molecular Weight 493.295 g/mol
SMILES Oc1c(c(cc(c1Cl)OC(c1c(c(Cl)c(cc1C)OC)O)=O)O)C(OCc1ccccc1)=O
SPLASH splash10-0006-9000000000-65b8fb572a80d9e62eac
Source of Spectrum B-44-1161-16
Wiley ID 1397493