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1-(2-Phenylethynyl)perfluorononanone

View entire compound with spectra: 1 MS (GC)

1-(2-Phenylethynyl)perfluorononanone
SpectraBase Compound ID ImBF43SRDSt
InChI InChI=1S/C17H5F17O/c18-10(19,9(35)7-6-8-4-2-1-3-5-8)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)16(30,31)17(32,33)34/h1-5H
InChIKey NWGHDOHWTGMFAH-UHFFFAOYSA-N
Mol Weight 548.2 g/mol
Molecular Formula C17H5F17O
Exact Mass 548.006894 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JwVmM6gxhwx
Name 1-(2-Phenylethynyl)perfluorononanone
Alternate Name(s) 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-1-phenyl-1-undecyn-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H5F17O
InChI InChI=1S/C17H5F17O/c18-10(19,9(35)7-6-8-4-2-1-3-5-8)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)16(30,31)17(32,33)34/h1-5H
InChIKey NWGHDOHWTGMFAH-UHFFFAOYSA-N
Molecular Weight 548.199 g/mol
SMILES C(C(C(C(C(C#Cc1ccccc1)=O)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-0ufr-0900000000-14deea6c1ea23d57ca8a
Source of Spectrum AJ-62-2639-6
Wiley ID 1405380