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12-KETE Me derivative
SpectraBase Compound ID 8S7hufSC9R5
InChI InChI=1S/C22H35NO3/c1-4-5-6-7-12-15-18-21(23-26-3)19-16-13-10-8-9-11-14-17-20-22(24)25-2/h9-13,15-16,19H,4-8,14,17-18,20H2,1-3H3/b11-9-,13-10-,15-12-,19-16+,23-21+
InChIKey DZXPPKODWZXORS-ZDYXNDMYSA-N
Mol Weight 361.5 g/mol
Molecular Formula C22H35NO3
Exact Mass 361.261694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgFcXBuHUq5
Name 12-KETE Me derivative
Alternate Name(s) Methyl (5Z,8Z,10E,12E,14Z)-12-(methoxyimino)-5,8,10,14-icosatetraenoate
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Formula C22H35NO3
InChI InChI=1S/C22H35NO3/c1-4-5-6-7-12-15-18-21(23-26-3)19-16-13-10-8-9-11-14-17-20-22(24)25-2/h9-13,15-16,19H,4-8,14,17-18,20H2,1-3H3/b11-9-,13-10-,15-12-,19-16+,23-21+
InChIKey DZXPPKODWZXORS-ZDYXNDMYSA-N
Molecular Weight 361.526 g/mol
SMILES C(=O)(OC)CCC\C=C/C\C=C/C=C/C(=N/OC)C\C=C/CCCCC
SPLASH splash10-00di-0092000000-a3cbe788792f922cf99f
Source of Spectrum O-30-0-0
Wiley ID 1349103