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1,2-Diacetoxy-4-perfluorooctylbenzene

View entire compound with spectra: 1 MS (GC)

1,2-Diacetoxy-4-perfluorooctylbenzene
SpectraBase Compound ID QS9REvFJ0M
InChI InChI=1S/C18H9F17O4/c1-6(36)38-9-4-3-8(5-10(9)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 AEDCLARWYVIOSB-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 9mtqNq3G1UV
Name 1,2-Diacetoxy-4-perfluorooctylbenzene
Alternate Name(s) 2-(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)38-9-4-3-8(5-10(9)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 AEDCLARWYVIOSB-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(c1cc(OC(=O)C)c(cc1)OC(=O)C)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-004i-0000090000-2f3dc9b74a320d384b7a
Source of Spectrum AJ-64-848-5
Wiley ID 771002