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[3-Cyano-4-(3,4-dimethoxy-phenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-pyridin-2-yloxy]-acetic acid ethyl ester
SpectraBase Compound ID E1X1atYX6R5
InChI InChI=1S/C28H28N2O5/c1-4-34-27(31)17-35-28-23(16-29)22(20-11-12-25(32-2)26(14-20)33-3)15-24(30-28)21-10-9-18-7-5-6-8-19(18)13-21/h9-15H,4-8,17H2,1-3H3
InChIKey NQAMHJHIRJZZIH-UHFFFAOYSA-N
Mol Weight 472.54 g/mol
Molecular Formula C28H28N2O5
Exact Mass 472.199822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B41kQJ0ITb6
Name [3-Cyano-4-(3,4-dimethoxy-phenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-pyridin-2-yloxy]-acetic acid ethyl ester
Alternate Name(s) 2-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-2-pyridinyl]oxy]acetic acid ethyl ester ethyl 2-[3-cyano-4-(3,4-dimethoxyphenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-2-yl]oxyacetate ethyl 2-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-tetralin-6-yl-2-pyridyl]oxy]acetate ethyl 2-[3-cyano-4-(3,4-dimethoxyphenyl)-6-(5,6,7,8-tetrahydronaphthalen-2-yl)pyridin-2-yl]oxyethanoate
Comments Less than 3 mono-isotopic peaks
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Formula C28H28N2O5
InChI InChI=1S/C28H28N2O5/c1-4-34-27(31)17-35-28-23(16-29)22(20-11-12-25(32-2)26(14-20)33-3)15-24(30-28)21-10-9-18-7-5-6-8-19(18)13-21/h9-15H,4-8,17H2,1-3H3
InChIKey NQAMHJHIRJZZIH-UHFFFAOYSA-N
Molecular Weight 472.541 g/mol
SMILES c1(c(nc(cc1-c1cc(OC)c(cc1)OC)-c1cc2CCCCc2cc1)OCC(=O)OCC)C#N
SPLASH splash10-00di-0000900000-2cbbf7366a888355dd3c
Source of Spectrum F2-44-4554-7a
Wiley ID 1705796