p-Toluenesulfonic Acid Monohydrate

Product Description
CAT No.
ALN-S012038
CAS No.
6192-52-5
Mol. F.
C7H8O3S : H2O
Mol. Wt.
172.2 : 18.0
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Product Overview
Technical Data
Reference
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Product Overview
Chemical Name : 4-Methylbenzenesulfonic acid hydrate
Smiles : O=[S](O)(C1=CC=C(C)C=C1)=O.O
Inchi : InChI=1S/C14H9ClF3NO2/c15-12-7-6-9(8-11(12)14(16,17)18)19-13(20)21-10-4-2-1-3-5-10/h1-8H,(H,19,20)
Technical Data
Reference
Fragmentation pathways and differentiation of positional isomers of sorafenib and structural analogues by ESI-IT-MSn and ESI-Q-TOF-MS/MS coupled with DFT calculations
By Yu, Dandan; Liang, XianruinFrom Journal of Mass Spectrometry (2018), 53(7), 579-589.
Box-Behnken design based statistical modelling for optimization of U PLC-MS/MS method for analysis of sorafenib in bulk and tablets
By Wanii, Tanveer A.; Alanazi, Amer M.; Zargar, Seema; Ahmad, Ajaz; Drawish, Ibrahim A. – From Journal of Computational and Theoretical Nanoscience (2015), 12(10), 3598-3604
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