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Picolinyl 7,13-eicosadienoate

View entire compound with spectra: 1 NMR

Picolinyl 7,13-eicosadienoate
SpectraBase Compound ID G3Sx1b3CluH
InChI InChI=1S/C26H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26(28)29-24-25-20-19-22-27-23-25/h7-8,13-14,19-20,22-23H,2-6,9-12,15-18,21,24H2,1H3/b8-7-,14-13-
InChIKey HQXVROXLXXSPJK-WRKWTSPFSA-N
Mol Weight 399.6 g/mol
Molecular Formula C26H41NO2
Exact Mass 399.31373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BBrbXudOkYj
Name Picolinyl 7,13-eicosadienoate
Comments Computed using HOSE algorithm
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Exact Mass 399.313729562 u
Formula C26H41NO2
InChI InChI=1S/C26H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26(28)29-24-25-20-19-22-27-23-25/h7-8,13-14,19-20,22-23H,2-6,9-12,15-18,21,24H2,1H3/b8-7-,14-13-
InChIKey HQXVROXLXXSPJK-WRKWTSPFSA-N
Molecular Weight 399.619 g/mol
SMILES C1=CN=CC(=C1)COC(CCCCC\C=C/CCCC\C=C/CCCCCC)=O