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Methyl 4-methyl-5-(2-bromoethyl)-2-(4-methylphenylsulfanyl)-6-phenylbenzoate
SpectraBase Compound ID 6EmleX5DUmw
InChI InChI=1S/C24H23BrO2S/c1-16-9-11-19(12-10-16)28-21-15-17(2)20(13-14-25)22(23(21)24(26)27-3)18-7-5-4-6-8-18/h4-12,15H,13-14H2,1-3H3
InChIKey UXNDJXOQJBLFNL-UHFFFAOYSA-N
Mol Weight 455.41 g/mol
Molecular Formula C24H23BrO2S
Exact Mass 454.060214 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HHV9Y6KhcdI
Name Methyl 4-methyl-5-(2-bromoethyl)-2-(4-methylphenylsulfanyl)-6-phenylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H23BrO2S
InChI InChI=1S/C24H23BrO2S/c1-16-9-11-19(12-10-16)28-21-15-17(2)20(13-14-25)22(23(21)24(26)27-3)18-7-5-4-6-8-18/h4-12,15H,13-14H2,1-3H3
InChIKey UXNDJXOQJBLFNL-UHFFFAOYSA-N
Molecular Weight 455.410 g/mol
SMILES c1(c(c(CCBr)c(cc1Sc1ccc(cc1)C)C)-c1ccccc1)C(=O)OC
SPLASH splash10-0gb9-0045900000-01599873007a5da0832f
Source of Spectrum F-65-7569-8j
Wiley ID 1680415