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2,6-dimethyl-4-[(4E,11E,18E)-tritriaconta-4,11,18-trienyl]-3,4-dihydropyridine
SpectraBase Compound ID EigMluxmiqs
InChI InChI=1S/C40H71N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-40-36-38(2)41-39(3)37-40/h17-18,24-25,31-32,36,40H,4-16,19-23,26-30,33-35,37H2,1-3H3/b18-17+,25-24+,32-31+
InChIKey VMXJUAFQLFHDRS-FMFOQKLUSA-N
Mol Weight 566.0 g/mol
Molecular Formula C40H71N
Exact Mass 565.558651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8xy60dHABd7
Name 2,6-dimethyl-4-[(4E,11E,18E)-tritriaconta-4,11,18-trienyl]-3,4-dihydropyridine
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Formula C40H71N
InChI InChI=1S/C40H71N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-40-36-38(2)41-39(3)37-40/h17-18,24-25,31-32,36,40H,4-16,19-23,26-30,33-35,37H2,1-3H3/b18-17+,25-24+,32-31+
InChIKey VMXJUAFQLFHDRS-FMFOQKLUSA-N
Ionization Type EI
Literature Reference DOI 10.1016/j.jasms.2006.01.015
Molecular Weight 566.015 g/mol
SMILES C1(CCC\C=C\CCCCC\C=C\CCCCC\C=C\CCCCCCCCCCCCCC)C=C(N=C(C1)C)C
SPLASH splash10-0a4j-1921000000-f1951704541859a2c57b
Source of Spectrum A7-17-715-Fig 2b
Wiley ID 1857484