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Ethyl 4-(perfluoro-1-butanesulfonyloxy)-1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylate
SpectraBase Compound ID 6dWSPHVkSHT
InChI InChI=1S/C13H14F9NO5S/c1-3-27-9(24)7-6-23(2)5-4-8(7)28-29(25,26)13(21,22)11(16,17)10(14,15)12(18,19)20/h3-6H2,1-2H3
InChIKey PWBMNSNMFYTVQP-UHFFFAOYSA-N
Mol Weight 467.3 g/mol
Molecular Formula C13H14F9NO5S
Exact Mass 467.044897 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KgdgtaIz9JY
Name Ethyl 4-(perfluoro-1-butanesulfonyloxy)-1-methyl-1,2,5,6-tetrahydropyridine-3-carboxylate
Alternate Name(s) Ethyl 1-methyl-4-{[(1,1,2,2,3,3,4,4,4-nonafluorobutyl)sulfonyl]oxy}-1,2,5,6-tetrahydro-3-pyridinecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14F9NO5S
InChI InChI=1S/C13H14F9NO5S/c1-3-27-9(24)7-6-23(2)5-4-8(7)28-29(25,26)13(21,22)11(16,17)10(14,15)12(18,19)20/h3-6H2,1-2H3
InChIKey PWBMNSNMFYTVQP-UHFFFAOYSA-N
Molecular Weight 467.303 g/mol
SMILES C(S(OC1=C(C(=O)OCC)CN(CC1)C)(=O)=O)(C(C(C(F)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-02ar-4900100000-8895a6b80f11c805c920
Source of Spectrum F-55-2108-7
Wiley ID 836806