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(8E,10E)-Dodeca-8,10-dien-1-yl 2,3,4,5,6-pentafluorobenzoate

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(8E,10E)-Dodeca-8,10-dien-1-yl 2,3,4,5,6-pentafluorobenzoate
SpectraBase Compound ID AbCqvuRs8f8
InChI InChI=1S/C19H21F5O2/c1-2-3-4-5-6-7-8-9-10-11-12-26-19(25)13-14(20)16(22)18(24)17(23)15(13)21/h2-5H,6-12H2,1H3/b3-2+,5-4+
InChIKey UQNSEOZRZJBKPX-MQQKCMAXSA-N
Mol Weight 376.37 g/mol
Molecular Formula C19H21F5O2
Exact Mass 376.146171 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Mmhyqcv1rR
Name (8E,10E)-Dodeca-8,10-dien-1-yl 2,3,4,5,6-pentafluorobenzoate
Comments Computed using HOSE algorithm
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Exact Mass 376.146170729 u
Formula C19H21F5O2
InChI InChI=1S/C19H21F5O2/c1-2-3-4-5-6-7-8-9-10-11-12-26-19(25)13-14(20)16(22)18(24)17(23)15(13)21/h2-5H,6-12H2,1H3/b3-2+,5-4+
InChIKey UQNSEOZRZJBKPX-MQQKCMAXSA-N
Molecular Weight 376.367 g/mol
SMILES C(\C=C\C=C\C)CCCCCCOC(C1=C(C(=C(F)C(=C1F)F)F)F)=O