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4-Acetoxy-2-acetoxymethyl-1-perfluorooctylbenzene

View entire compound with spectra: 1 MS (GC)

4-Acetoxy-2-acetoxymethyl-1-perfluorooctylbenzene
SpectraBase Compound ID GpFVr9uhCkY
InChI InChI=1S/C19H11F17O4/c1-7(37)39-6-9-5-10(40-8(2)38)3-4-11(9)12(20,21)13(22,23)14(24,25)15(26,27)16(28,29)17(30,31)18(32,33)19(34,35)36/h3-5H,6H2,1-2H3
InChIKey KEWCLSZUCDTJJU-UHFFFAOYSA-N
Mol Weight 626.27 g/mol
Molecular Formula C19H11F17O4
Exact Mass 626.038588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F42eH0UupVb
Name 4-Acetoxy-2-acetoxymethyl-1-perfluorooctylbenzene
Alternate Name(s) 5-(acetyloxy)-2-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)benzyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H11F17O4
InChI InChI=1S/C19H11F17O4/c1-7(37)39-6-9-5-10(40-8(2)38)3-4-11(9)12(20,21)13(22,23)14(24,25)15(26,27)16(28,29)17(30,31)18(32,33)19(34,35)36/h3-5H,6H2,1-2H3
InChIKey KEWCLSZUCDTJJU-UHFFFAOYSA-N
Molecular Weight 626.266 g/mol
SMILES C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(C(C(C(c1c(cc(cc1)OC(=O)C)COC(=O)C)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-0006-0200090000-65facc4280f0d86b957b
Source of Spectrum AJ-64-848-7
Wiley ID 1411849