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4-[bis(2-methylsulfonyloxyethyl)amino]-2-fluoro-benzoic acid tert-butyl ester
SpectraBase Compound ID 8VaCfTzLI93
InChI InChI=1S/C17H26FNO8S2/c1-17(2,3)27-16(20)14-7-6-13(12-15(14)18)19(8-10-25-28(4,21)22)9-11-26-29(5,23)24/h6-7,12H,8-11H2,1-5H3
InChIKey DTVZVGUVDZXZOM-UHFFFAOYSA-N
Mol Weight 455.51 g/mol
Molecular Formula C17H26FNO8S2
Exact Mass 455.108387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xDuadm7TdH
Name 4-[bis(2-methylsulfonyloxyethyl)amino]-2-fluoro-benzoic acid tert-butyl ester
Alternate Name(s) tert-Butyl 4-[bis(2-methylsulfonyloxyethyl)amino]-2-fluoranyl-benzoate 4-[bis(2-methylsulfonyloxyethyl)amino]-2-fluorobenzoic acid tert-butyl ester tert-Butyl 4-[bis(2-methylsulfonyloxyethyl)amino]-2-fluorobenzoate
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Formula C17H26FNO8S2
InChI InChI=1S/C17H26FNO8S2/c1-17(2,3)27-16(20)14-7-6-13(12-15(14)18)19(8-10-25-28(4,21)22)9-11-26-29(5,23)24/h6-7,12H,8-11H2,1-5H3
InChIKey DTVZVGUVDZXZOM-UHFFFAOYSA-N
Molecular Weight 455.512 g/mol
SMILES C(c1c(cc(cc1)N(CCOS(=O)(=O)C)CCOS(=O)(=O)C)F)(=O)OC(C)(C)C
SPLASH splash10-0006-0093000000-b3ce57a2bff307ba6cec
Source of Spectrum E1-37-2368-29
Wiley ID 1575152