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2,4-Diacetoxy-1-perfluorooctylbenzene

View entire compound with spectra: 1 MS (GC)

2,4-Diacetoxy-1-perfluorooctylbenzene
SpectraBase Compound ID Dn7rMOUnwre
InChI InChI=1S/C18H9F17O4/c1-6(36)38-8-3-4-9(10(5-8)39-7(2)37)11(19,20)12(21,22)13(23,24)14(25,26)15(27,28)16(29,30)17(31,32)18(33,34)35/h3-5H,1-2H3
InChIKey CGVWWWWUZOGFFA-UHFFFAOYSA-N
Mol Weight 612.24 g/mol
Molecular Formula C18H9F17O4
Exact Mass 612.022938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I7iSjdeIouW
Name 2,4-Diacetoxy-1-perfluorooctylbenzene
Alternate Name(s) 3-(acetyloxy)-4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)phenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H9F17O4
InChI InChI=1S/C18H9F17O4/c1-6(36)38-8-3-4-9(10(5-8)39-7(2)37)11(19,20)12(21,22)13(23,24)14(25,26)15(27,28)16(29,30)17(31,32)18(33,34)35/h3-5H,1-2H3
InChIKey CGVWWWWUZOGFFA-UHFFFAOYSA-N
Molecular Weight 612.239 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)OC(=O)C)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-0ufr-0900080000-2411bde75dab1305ca8b
Source of Spectrum AJ-64-848-3
Wiley ID 1410997