For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzoic acid, 4-(2-bromoethyl)-, 4-[(phenylamino)sulfonyl]phenyl ester
SpectraBase Compound ID ugCOqHYjK1
InChI InChI=1S/C21H18BrNO4S/c22-15-14-16-6-8-17(9-7-16)21(24)27-19-10-12-20(13-11-19)28(25,26)23-18-4-2-1-3-5-18/h1-13,23H,14-15H2
InChIKey YVWVJRQOIPZQMI-UHFFFAOYSA-N
Mol Weight 460.34 g/mol
Molecular Formula C21H18BrNO4S
Exact Mass 459.013992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3zCxpY9EJNL
Name Benzoic acid, 4-(2-bromoethyl)-, 4-[(phenylamino)sulfonyl]phenyl ester
Alternate Name(s) 4-(N-phenylsulfamoyl)phenyl 4-(2-bromoethyl)benzoate 4-(Phenylsulfamoyl)phenyl 4-(2-bromoethyl)benzoate [4-(phenylsulfamoyl)phenyl] 4-(2-bromoethyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18BrNO4S
InChI InChI=1S/C21H18BrNO4S/c22-15-14-16-6-8-17(9-7-16)21(24)27-19-10-12-20(13-11-19)28(25,26)23-18-4-2-1-3-5-18/h1-13,23H,14-15H2
InChIKey YVWVJRQOIPZQMI-UHFFFAOYSA-N
Molecular Weight 460.342 g/mol
SMILES N(S(c1ccc(OC(c2ccc(CCBr)cc2)=O)cc1)(=O)=O)c1ccccc1
SPLASH splash10-03di-6690000000-ba4c30b06b64de899d1b
Source of Spectrum JX-2015-4-700
Wiley ID 1726120