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Methyl 5-(5-Bromo-2-hydroxybenzoyl)-3-(4-tolyl)salicylate
SpectraBase Compound ID J50wAwwDdQj
InChI InChI=1S/C22H17BrO5/c1-12-3-5-13(6-4-12)16-9-14(10-18(21(16)26)22(27)28-2)20(25)17-11-15(23)7-8-19(17)24/h3-11,24,26H,1-2H3
InChIKey KAJPVZRYQKUHNL-UHFFFAOYSA-N
Mol Weight 441.28 g/mol
Molecular Formula C22H17BrO5
Exact Mass 440.025937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BiJoIpFIaUQ
Name Methyl 5-(5-Bromo-2-hydroxybenzoyl)-3-(4-tolyl)salicylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17BrO5
InChI InChI=1S/C22H17BrO5/c1-12-3-5-13(6-4-12)16-9-14(10-18(21(16)26)22(27)28-2)20(25)17-11-15(23)7-8-19(17)24/h3-11,24,26H,1-2H3
InChIKey KAJPVZRYQKUHNL-UHFFFAOYSA-N
Molecular Weight 441.277 g/mol
SMILES Oc1c(C(c2cc(c(c(c2)-c2ccc(cc2)C)O)C(=O)OC)=O)cc(cc1)Br
SPLASH splash10-01ox-0110900000-64f5ee36dbe6a0993912
Source of Spectrum F4-41-249-14
Wiley ID 1711666