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7,13-Docosadienoic acid, dmox derivative

View entire compound with spectra: 1 NMR

7,13-Docosadienoic acid, dmox derivative
SpectraBase Compound ID 1yzE8701rwX
InChI InChI=1S/C26H47NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-27-26(2,3)24-28-25/h11-12,17-18H,4-10,13-16,19-24H2,1-3H3/b12-11-,18-17-
InChIKey KGWLBJNLYZVZQI-YGWYKEQZSA-N
Mol Weight 389.7 g/mol
Molecular Formula C26H47NO
Exact Mass 389.365765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7EsC4iZJDX9
Name 7,13-Docosadienoic acid, dmox derivative
Comments Computed using HOSE algorithm
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Exact Mass 389.365765136 u
Formula C26H47NO
InChI InChI=1S/C26H47NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-27-26(2,3)24-28-25/h11-12,17-18H,4-10,13-16,19-24H2,1-3H3/b12-11-,18-17-
InChIKey KGWLBJNLYZVZQI-YGWYKEQZSA-N
Molecular Weight 389.668 g/mol
SMILES C(CC\C=C/CCCCCC=1OCC(N1)(C)C)C\C=C/CCCCCCCC