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1-Chloro-1,1,2,2,3,3,4,4,5,5,6,6-dodecafluoro-8-iodotetradecane
SpectraBase Compound ID HLwBO80vuk8
InChI InChI=1S/C14H16ClF12I/c1-2-3-4-5-6-8(28)7-9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)14(15,26)27/h8H,2-7H2,1H3
InChIKey MQPYHONGYJMYMG-UHFFFAOYSA-N
Mol Weight 574.62 g/mol
Molecular Formula C14H16ClF12I
Exact Mass 573.979361 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID lTOg8ONjSL
Name 1-Chloro-1,1,2,2,3,3,4,4,5,5,6,6-dodecafluoro-8-iodotetradecane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 573.979361171 u
Formula C14H16ClF12I
InChI InChI=1S/C14H16ClF12I/c1-2-3-4-5-6-8(28)7-9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)14(15,26)27/h8H,2-7H2,1H3
InChIKey MQPYHONGYJMYMG-UHFFFAOYSA-N
Molecular Weight 574.620 g/mol
SMILES C(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(CC(I)CCCCCC)(F)F)(Cl)(F)F