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2,6-bis[Imidazol-1'-yl)methyl]-4-chlorophenol
SpectraBase Compound ID 5sL0ppCCuq4
InChI InChI=1S/C14H13ClN4O/c15-13-5-11(7-18-3-1-16-9-18)14(20)12(6-13)8-19-4-2-17-10-19/h1-6,9-10,20H,7-8H2
InChIKey PKQMIWUBLBJKRV-UHFFFAOYSA-N
Mol Weight 288.74 g/mol
Molecular Formula C14H13ClN4O
Exact Mass 288.077789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jRUXVpT6sQ
Name 2,6-bis[Imidazol-1'-yl)methyl]-4-chlorophenol
Comments Less than 3 mono-isotopic peaks
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Formula C14H13ClN4O
InChI InChI=1S/C14H13ClN4O/c15-13-5-11(7-18-3-1-16-9-18)14(20)12(6-13)8-19-4-2-17-10-19/h1-6,9-10,20H,7-8H2
InChIKey PKQMIWUBLBJKRV-UHFFFAOYSA-N
Molecular Weight 288.738 g/mol
SMILES Oc1c(C[n]2cncc2)cc(cc1C[n]1cncc1)Cl
SPLASH splash10-00e0-0090000000-80135c89d14afd2edf72
Source of Spectrum SK-24-51-3
Synonyms 4-chloro-2,6-bis(1-imidazolylmethyl)phenol 4-chloranyl-2,6-bis(imidazol-1-ylmethyl)phenol
Wiley ID 866092