4-[bis(2-methylsulfonyloxyethyl)amino]-2-fluoranyl-benzoic acid

SpectraBase Compound ID	FCLMphKwLZ
InChI	InChI=1S/C13H18FNO8S2/c1-24(18,19)22-7-5-15(6-8-23-25(2,20)21)10-3-4-11(13(16)17)12(14)9-10/h3-4,9H,5-8H2,1-2H3,(H,16,17)
InChIKey	SOFNCOJAPOPJQL-UHFFFAOYSA-N Google Search
Mol Weight	399.4 g/mol
Molecular Formula	C13H18FNO8S2
Exact Mass	399.045787 g/mol

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SpectraBase Spectrum ID	KVsIHfVDHhp
Name	4-[bis(2-methylsulfonyloxyethyl)amino]-2-fluoranyl-benzoic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H18FNO8S2
InChI	InChI=1S/C13H18FNO8S2/c1-24(18,19)22-7-5-15(6-8-23-25(2,20)21)10-3-4-11(13(16)17)12(14)9-10/h3-4,9H,5-8H2,1-2H3,(H,16,17)
InChIKey	SOFNCOJAPOPJQL-UHFFFAOYSA-N
Molecular Weight	399.404 g/mol
SMILES	OC(c1c(cc(cc1)N(CCOS(=O)(=O)C)CCOS(=O)(=O)C)F)=O
SPLASH	splash10-0007-0091000000-dc3b2345408b9d8894a5
Source of Spectrum	E1-37-2368-10
Synonyms	4-[bis(2-methylsulfonyloxyethyl)amino]-2-fluorobenzoic acid
Wiley ID	1575150