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1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-Uneicofluorododecane-12-carboxamide

View entire compound with spectra: 2 NMR

1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-Uneicofluorododecane-12-carboxamide
SpectraBase Compound ID E4cXWnDriwJ
InChI InChI=1S/C13H6F21NO/c14-4(15,2-1-3(35)36)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)10(26,27)11(28,29)12(30,31)13(32,33)34/h1-2H2,(H2,35,36)
InChIKey PISPSFJRLGJGRG-UHFFFAOYSA-N
Mol Weight 591.16 g/mol
Molecular Formula C13H6F21NO
Exact Mass 591.011405 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8dk3WDfsewM
Name 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-Uneicofluorododecane-12-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 591.011405239 u
Formula C13H6F21NO
InChI InChI=1S/C13H6F21NO/c14-4(15,2-1-3(35)36)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)10(26,27)11(28,29)12(30,31)13(32,33)34/h1-2H2,(H2,35,36)
InChIKey PISPSFJRLGJGRG-UHFFFAOYSA-N
Molecular Weight 591.163 g/mol
SMILES NC(CCC(C(C(F)(F)C(C(F)(F)C(C(F)(F)C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)=O