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Decan-2-yl 2,3,4,5,6-pentafluorobenzoate
SpectraBase Compound ID 1G6evffjEUq
InChI InChI=1S/C17H21F5O2/c1-3-4-5-6-7-8-9-10(2)24-17(23)11-12(18)14(20)16(22)15(21)13(11)19/h10H,3-9H2,1-2H3
InChIKey RMOYAZMJLBETSH-UHFFFAOYSA-N
Mol Weight 352.35 g/mol
Molecular Formula C17H21F5O2
Exact Mass 352.146171 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IapbPnuaREx
Name Decan-2-yl 2,3,4,5,6-pentafluorobenzoate
Comments Computed using HOSE algorithm
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Exact Mass 352.146170729 u
Formula C17H21F5O2
InChI InChI=1S/C17H21F5O2/c1-3-4-5-6-7-8-9-10(2)24-17(23)11-12(18)14(20)16(22)15(21)13(11)19/h10H,3-9H2,1-2H3
InChIKey RMOYAZMJLBETSH-UHFFFAOYSA-N
Molecular Weight 352.345 g/mol
SMILES C(=O)(C1=C(C(=C(C(=C1F)F)F)F)F)OC(C)CCCCCCCC