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4-[2-chloroethyl(2-methylsulfonyloxyethyl)amino]-3-fluoranyl-benzoic acid
SpectraBase Compound ID Axzg8DcH42d
InChI InChI=1S/C12H15ClFNO5S/c1-21(18,19)20-7-6-15(5-4-13)11-3-2-9(12(16)17)8-10(11)14/h2-3,8H,4-7H2,1H3,(H,16,17)
InChIKey SREGGMGSVWWZIU-UHFFFAOYSA-N
Mol Weight 339.77 g/mol
Molecular Formula C12H15ClFNO5S
Exact Mass 339.03435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID k0KEbKsEyX
Name 4-[2-chloroethyl(2-methylsulfonyloxyethyl)amino]-3-fluoranyl-benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15ClFNO5S
InChI InChI=1S/C12H15ClFNO5S/c1-21(18,19)20-7-6-15(5-4-13)11-3-2-9(12(16)17)8-10(11)14/h2-3,8H,4-7H2,1H3,(H,16,17)
InChIKey SREGGMGSVWWZIU-UHFFFAOYSA-N
Molecular Weight 339.765 g/mol
SMILES OC(c1cc(c(cc1)N(CCOS(=O)(=O)C)CCCl)F)=O
SPLASH splash10-001i-0090000000-c612b7c3d7e3274a0d32
Source of Spectrum E1-37-2369-23
Synonyms 4-[2-chloroethyl(2-methylsulfonyloxyethyl)amino]-3-fluorobenzoic acid
Wiley ID 1575142