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5-[6-(2,3-dihydroxy-4-pentylphenyl)hexyl]-5'-hexyl-2,2'-bipyridine
SpectraBase Compound ID KvTjmEMosj3
InChI InChI=1S/C33H46N2O2/c1-3-5-7-11-14-26-18-22-30(34-24-26)31-23-19-27(25-35-31)15-12-8-9-13-17-29-21-20-28(16-10-6-4-2)32(36)33(29)37/h18-25,36-37H,3-17H2,1-2H3
InChIKey GZXJHCHDGYYOIN-UHFFFAOYSA-N
Mol Weight 502.7 g/mol
Molecular Formula C33H46N2O2
Exact Mass 502.355929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kbm7nTyYX4n
Name 5-[6-(2,3-dihydroxy-4-pentylphenyl)hexyl]-5'-hexyl-2,2'-bipyridine
Comments Less than 3 mono-isotopic peaks
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Formula C33H46N2O2
InChI InChI=1S/C33H46N2O2/c1-3-5-7-11-14-26-18-22-30(34-24-26)31-23-19-27(25-35-31)15-12-8-9-13-17-29-21-20-28(16-10-6-4-2)32(36)33(29)37/h18-25,36-37H,3-17H2,1-2H3
InChIKey GZXJHCHDGYYOIN-UHFFFAOYSA-N
Molecular Weight 502.743 g/mol
SMILES Oc1c(c(ccc1CCCCC)CCCCCCc1cnc(-c2ncc(cc2)CCCCCC)cc1)O
SPLASH splash10-0udi-0010090000-c25c004eb103cabc61e1
Source of Spectrum SO-0-960-14
Synonyms 3-{6-[6-(5-hexylpyridin-2-yl)pyridin-3-yl]hexyl}-6-pentylbenzene-1,2-diol
Wiley ID 874734