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picolinyl eicosa-12,15-dienoate
SpectraBase Compound ID IpiXyCkH6ku
InChI InChI=1S/C26H41NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26(28)29-25-21-20-23-27-24(25)2/h6-7,9-10,20-21,23H,3-5,8,11-19,22H2,1-2H3/b7-6+,10-9+
InChIKey CDJABYNCXKTZKS-AVQMFFATSA-N
Mol Weight 399.6 g/mol
Molecular Formula C26H41NO2
Exact Mass 399.31373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 79piY1wDPAj
Name picolinyl eicosa-12,15-dienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H41NO2
InChI InChI=1S/C26H41NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26(28)29-25-21-20-23-27-24(25)2/h6-7,9-10,20-21,23H,3-5,8,11-19,22H2,1-2H3/b7-6+,10-9+
InChIKey CDJABYNCXKTZKS-AVQMFFATSA-N
Molecular Weight 399.619 g/mol
SMILES c1(OC(=O)CCCCCCCCCC\C=C\C\C=C\CCCC)c(nccc1)C
SPLASH splash10-0006-9043000000-48d6d0747567cf143faa
Source of Spectrum JC-521-94-13
Synonyms 2-Methyl-3-pyridinyl (12E,15E)-12,15-icosadienoate
Wiley ID 1369113