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Benzoic acid, 4-(2-bromoethyl)-, 4-[[[(phenylmethyl)sulfonyl]amino]methyl]phenyl ester
SpectraBase Compound ID woRnC8DDBm
InChI InChI=1S/C23H22BrNO4S/c24-15-14-18-6-10-21(11-7-18)23(26)29-22-12-8-19(9-13-22)16-25-30(27,28)17-20-4-2-1-3-5-20/h1-13,25H,14-17H2
InChIKey IZNQFNOBYMNAGO-UHFFFAOYSA-N
Mol Weight 488.4 g/mol
Molecular Formula C23H22BrNO4S
Exact Mass 487.045292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H5nT7lzbnmC
Name Benzoic acid, 4-(2-bromoethyl)-, 4-[[[(phenylmethyl)sulfonyl]amino]methyl]phenyl ester
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Formula C23H22BrNO4S
InChI InChI=1S/C23H22BrNO4S/c24-15-14-18-6-10-21(11-7-18)23(26)29-22-12-8-19(9-13-22)16-25-30(27,28)17-20-4-2-1-3-5-20/h1-13,25H,14-17H2
InChIKey IZNQFNOBYMNAGO-UHFFFAOYSA-N
Molecular Weight 488.396 g/mol
SMILES N(Cc1ccc(OC(c2ccc(CCBr)cc2)=O)cc1)S(=O)(=O)Cc1ccccc1
SPLASH splash10-03di-7490000000-bbbf140c8c2be8d4b42d
Source of Spectrum JX-2015-4-878
Synonyms 4-((phenylmethylsulfonamido)methyl)phenyl 4-(2-bromoethyl)benzoate 4-{[(benzylsulfonyl)amino]methyl}phenyl 4-(2-bromoethyl)benzoate 4-(2-bromoethyl)benzoic acid [4-[[(phenylmethyl)sulfonylamino]methyl]phenyl] ester [4-[(benzylsulfonylamino)methyl]phenyl] 4-(2-bromoethyl)benzoate [4-[[(phenylmethyl)sulfonylamino]methyl]phenyl] 4-(2-bromoethyl)benzoate
Wiley ID 1726291