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2,6-Pyridinedicarboxylic acid, 2,2,3,3,4,4,4-heptafluorobutyl but-2-yl ester
SpectraBase Compound ID CdnVm3nNyjb
InChI InChI=1S/C15H14F7NO4/c1-3-8(2)27-12(25)10-6-4-5-9(23-10)11(24)26-7-13(16,17)14(18,19)15(20,21)22/h4-6,8H,3,7H2,1-2H3
InChIKey CUMGVNRQZSMECY-UHFFFAOYSA-N
Mol Weight 405.27 g/mol
Molecular Formula C15H14F7NO4
Exact Mass 405.081105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2d8TLX7anCE
Name 2,6-Pyridinedicarboxylic acid, 2,2,3,3,4,4,4-heptafluorobutyl but-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14F7NO4
InChI InChI=1S/C15H14F7NO4/c1-3-8(2)27-12(25)10-6-4-5-9(23-10)11(24)26-7-13(16,17)14(18,19)15(20,21)22/h4-6,8H,3,7H2,1-2H3
InChIKey CUMGVNRQZSMECY-UHFFFAOYSA-N
Molecular Weight 405.269 g/mol
SMILES C(OC(c1nc(ccc1)C(OCC(C(C(F)(F)F)(F)F)(F)F)=O)=O)(CC)C
SPLASH splash10-0zfr-7709000000-b1263fca1833ecdd4986
Source of Spectrum TIPS-2023-1002-0
Wiley ID 1885708