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2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoroheptyl 4-methylbenzenesulfonate
SpectraBase Compound ID Gj0DhrWJG7Y
InChI InChI=1S/C14H10F12O3S/c1-7-2-4-8(5-3-7)30(27,28)29-6-10(17,18)12(21,22)14(25,26)13(23,24)11(19,20)9(15)16/h2-5,9H,6H2,1H3
InChIKey OXJVZWUUXGCJLH-UHFFFAOYSA-N
Mol Weight 486.27 g/mol
Molecular Formula C14H10F12O3S
Exact Mass 486.015903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DTJSn7p1fFc
Name 2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoroheptyl 4-methylbenzenesulfonate
Alternate Name(s) 2,2,3,3,4,4,5,5,6,6,7,7-Dodecafluoroheptyl 4-methylbenzene-1-sulfonate 2,2,3,3,4,4,5,5,6,6,7,7-dodecakis(fluoranyl)heptyl 4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid 2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl ester
CAS Registry Number 424-16-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H10F12O3S
InChI InChI=1S/C14H10F12O3S/c1-7-2-4-8(5-3-7)30(27,28)29-6-10(17,18)12(21,22)14(25,26)13(23,24)11(19,20)9(15)16/h2-5,9H,6H2,1H3
InChIKey OXJVZWUUXGCJLH-UHFFFAOYSA-N
Molecular Weight 486.272 g/mol
SMILES C(C(C(C(F)F)(F)F)(F)F)(C(C(COS(c1ccc(C)cc1)(=O)=O)(F)F)(F)F)(F)F
SPLASH splash10-052f-9400000000-fab342c4ecf9bc56a0f4
Wiley ID 1456835