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1-[2-(1-adamantyl)ethyl]-4-(2-ethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 6sfdQLt2Evo
InChI InChI=1S/C29H37NO5/c1-4-35-25-8-6-5-7-22(25)26-23(27(31)33-2)17-30(18-24(26)28(32)34-3)10-9-29-14-19-11-20(15-29)13-21(12-19)16-29/h5-8,17-21,26H,4,9-16H2,1-3H3
InChIKey VUZFOGHGBCXVNY-UHFFFAOYSA-N
Mol Weight 479.6 g/mol
Molecular Formula C29H37NO5
Exact Mass 479.267173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C3qrK3efBs3
Name 1-[2-(1-adamantyl)ethyl]-4-(2-ethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
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Formula C29H37NO5
InChI InChI=1S/C29H37NO5/c1-4-35-25-8-6-5-7-22(25)26-23(27(31)33-2)17-30(18-24(26)28(32)34-3)10-9-29-14-19-11-20(15-29)13-21(12-19)16-29/h5-8,17-21,26H,4,9-16H2,1-3H3
InChIKey VUZFOGHGBCXVNY-UHFFFAOYSA-N
Molecular Weight 479.617 g/mol
SMILES C=1(C(C(C(=O)OC)=CN(C1)CCC12CC3CC(C2)CC(C1)C3)c1c(OCC)cccc1)C(=O)OC
SPLASH splash10-054x-9401100000-a018d660da22b7aa1043
Synonyms 1-[2-(1-adamantyl)ethyl]-4-o-phenetyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Dimethyl 1-[2-(1-adamantyl)ethyl]-4-(2-ethoxyphenyl)-4H-pyridine-3,5-dicarboxylate
Wiley ID 1463986