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4-[2-(2-Hydroxyphenyl)ethenyl]-2,6-dphenylpyridino}phenoate
SpectraBase Compound ID D1TOQoaM4JA
InChI InChI=1S/C31H23NO2.ClHO4/c33-28-19-17-27(18-20-28)32-29(24-9-3-1-4-10-24)21-23(15-16-26-13-7-8-14-31(26)34)22-30(32)25-11-5-2-6-12-25;2-1(3,4)5/h1-22,33H;(H,2,3,4,5)
InChIKey WKWWJVWPBKKBKS-UHFFFAOYSA-N
Mol Weight 541.99 g/mol
Molecular Formula C31H24ClNO6
Exact Mass 541.129215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7kgjQcs9ZXi
Name 4-[2-(2-Hydroxyphenyl)ethenyl]-2,6-dphenylpyridino}phenoate
Alternate Name(s) 4-[2-(2-Hydroxyphenyl)ethenyl]-2,6-dphenylpyridino}phenoate-perchlorate salt
Comments Less than 3 mono-isotopic peaks
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Formula C31H24ClNO6
InChI InChI=1S/C31H23NO2.ClHO4/c33-28-19-17-27(18-20-28)32-29(24-9-3-1-4-10-24)21-23(15-16-26-13-7-8-14-31(26)34)22-30(32)25-11-5-2-6-12-25;2-1(3,4)5/h1-22,33H;(H,2,3,4,5)
InChIKey WKWWJVWPBKKBKS-UHFFFAOYSA-N
Molecular Weight 541.987 g/mol
SMILES [Cl]([O-])(=O)(=O)=O.Oc1c(\C=C\c2cc([n+](-c3ccc(cc3)O)c(c2)-c2ccccc2)-c2ccccc2)cccc1
SPLASH splash10-000i-2009000000-0f57cff1b6625b9213bd
Source of Spectrum H1-35-877-10
Wiley ID 755045