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4-Propyl-'-(2",2",3",3",3"-pentafluoropropyl)-bis(cyclohexyl)

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-Propyl-'-(2",2",3",3",3"-pentafluoropropyl)-bis(cyclohexyl)
SpectraBase Compound ID HH9ObuYX59W
InChI InChI=1S/C18H29F5/c1-2-3-13-4-8-15(9-5-13)16-10-6-14(7-11-16)12-17(19,20)18(21,22)23/h13-16H,2-12H2,1H3/t13-,14-,15-,16+
InChIKey JEFBVXRMJVGNTF-ZNNBLSDJSA-N
Mol Weight 340.42 g/mol
Molecular Formula C18H29F5
Exact Mass 340.218942 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CHWZnFpf4CM
Name 4-Propyl-'-(2'',2'',3'',3'',3''-pentafluoropropyl)-bis(cyclohexyl)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.218941749 u
Formula C18H29F5
InChI InChI=1S/C18H29F5/c1-2-3-13-4-8-15(9-5-13)16-10-6-14(7-11-16)12-17(19,20)18(21,22)23/h13-16H,2-12H2,1H3/t13-,14-,15-,16+
InChIKey JEFBVXRMJVGNTF-ZNNBLSDJSA-N
Molecular Weight 340.422 g/mol
SMILES C(C(C[C@]1(CC[C@@]([C@]2(CC[C@@](CC2)(CCC)[H])[H])(CC1)[H])[H])(F)F)(F)(F)F