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Benzoic acid, 4-(2-bromoethyl)-, 4-[(ethylsulfonyl)amino]phenyl ester
SpectraBase Compound ID DJZbm4NQ2dW
InChI InChI=1S/C17H18BrNO4S/c1-2-24(21,22)19-15-7-9-16(10-8-15)23-17(20)14-5-3-13(4-6-14)11-12-18/h3-10,19H,2,11-12H2,1H3
InChIKey WLSAANOVVBUESF-UHFFFAOYSA-N
Mol Weight 412.3 g/mol
Molecular Formula C17H18BrNO4S
Exact Mass 411.013992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kGsZNTeAx4
Name Benzoic acid, 4-(2-bromoethyl)-, 4-[(ethylsulfonyl)amino]phenyl ester
Alternate Name(s) 4-(ethylsulfonamido)phenyl 4-(2-bromoethyl)benzoate 4-[(ethylsulfonyl)amino]phenyl 4-(2-bromoethyl)benzoate 4-(2-bromoethyl)benzoic acid [4-(ethylsulfonylamino)phenyl] ester [4-(ethylsulfonylamino)phenyl] 4-(2-bromoethyl)benzoate
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Formula C17H18BrNO4S
InChI InChI=1S/C17H18BrNO4S/c1-2-24(21,22)19-15-7-9-16(10-8-15)23-17(20)14-5-3-13(4-6-14)11-12-18/h3-10,19H,2,11-12H2,1H3
InChIKey WLSAANOVVBUESF-UHFFFAOYSA-N
Molecular Weight 412.298 g/mol
SMILES N(S(CC)(=O)=O)c1ccc(OC(=O)c2ccc(CCBr)cc2)cc1
SPLASH splash10-03di-3590000000-dc4440b4b04564e36959
Source of Spectrum JX-2015-4-174
Wiley ID 1725623