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[4-(2-chloranylpyridin-4-yl)-3-(hydroxymethyl)-7-methoxy-6-phenylmethoxy-naphthalen-2-yl]methanol
SpectraBase Compound ID CwSaW3CBmC6
InChI InChI=1S/C25H22ClNO4/c1-30-22-10-18-9-19(13-28)21(14-29)25(17-7-8-27-24(26)11-17)20(18)12-23(22)31-15-16-5-3-2-4-6-16/h2-12,28-29H,13-15H2,1H3
InChIKey LAYHQVPSCIJOJX-UHFFFAOYSA-N
Mol Weight 435.91 g/mol
Molecular Formula C25H22ClNO4
Exact Mass 435.123736 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3aLMLsCyRg9
Name [4-(2-chloranylpyridin-4-yl)-3-(hydroxymethyl)-7-methoxy-6-phenylmethoxy-naphthalen-2-yl]methanol
Alternate Name(s) [4-(2-chloro-4-pyridinyl)-3-(hydroxymethyl)-7-methoxy-6-phenylmethoxy-2-naphthalenyl]methanol [4-(2-chloropyridin-4-yl)-3-(hydroxymethyl)-7-methoxy-6-phenylmethoxynaphthalen-2-yl]methanol [6-benzoxy-4-(2-chloro-4-pyridyl)-7-methoxy-3-methylol-2-naphthyl]methanol [6-benzyloxy-4-(2-chloro-4-pyridyl)-3-(hydroxymethyl)-7-methoxy-2-naphthyl]methanol
Comments Less than 3 mono-isotopic peaks
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Formula C25H22ClNO4
InChI InChI=1S/C25H22ClNO4/c1-30-22-10-18-9-19(13-28)21(14-29)25(17-7-8-27-24(26)11-17)20(18)12-23(22)31-15-16-5-3-2-4-6-16/h2-12,28-29H,13-15H2,1H3
InChIKey LAYHQVPSCIJOJX-UHFFFAOYSA-N
Molecular Weight 435.907 g/mol
SMILES OCc1cc2c(c(c1CO)-c1cc(ncc1)Cl)cc(c(c2)OC)OCc1ccccc1
SPLASH splash10-000f-9000700000-4c76cfdb87862b1a8182
Source of Spectrum F2-42-1096-12
Wiley ID 1600052