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BENZYL-3-BROMO-5-METHOXY-4-(PARA-TOLYLSULFONYLOXY)-BENZOATE
SpectraBase Compound ID BJoC13Duy8P
InChI InChI=1S/C22H19BrO6S/c1-15-8-10-18(11-9-15)30(25,26)29-21-19(23)12-17(13-20(21)27-2)22(24)28-14-16-6-4-3-5-7-16/h3-13H,14H2,1-2H3
InChIKey NEYZPCCFRFDUMC-UHFFFAOYSA-N
Mol Weight 491.35 g/mol
Molecular Formula C22H19BrO6S
Exact Mass 490.008572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9X9MmxRNJVt
Name Benzyl 3-bromo-5-methoxy-4-(p-tolylsulfonyloxy)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19BrO6S
InChI InChI=1S/C22H19BrO6S/c1-15-8-10-18(11-9-15)30(25,26)29-21-19(23)12-17(13-20(21)27-2)22(24)28-14-16-6-4-3-5-7-16/h3-13H,14H2,1-2H3
InChIKey NEYZPCCFRFDUMC-UHFFFAOYSA-N
Molecular Weight 491.352 g/mol
SMILES c1(OS(c2ccc(cc2)C)(=O)=O)c(cc(cc1OC)C(OCc1ccccc1)=O)Br
SPLASH splash10-0006-9000000000-9a1dfc12e3aaf79106dd
Source of Spectrum KC-0-3033-22
Synonyms (phenylmethyl) 3-bromanyl-5-methoxy-4-(4-methylphenyl)sulfonyloxy-benzoate 3-Bromo-5-methoxy-4-(4-methylphenyl)sulfonyloxybenzoic acid (phenylmethyl) ester 3-Bromo-5-methoxy-4-tosyloxy-benzoic acid benzyl ester
Wiley ID 829189