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1-[2-(1-adamantyl)ethyl]-4-(3,4,5-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester

View entire compound with spectra: 1 MS (GC)

1-[2-(1-adamantyl)ethyl]-4-(3,4,5-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID LYwacUCXCsS
InChI InChI=1S/C30H39NO7/c1-34-24-11-21(12-25(35-2)27(24)36-3)26-22(28(32)37-4)16-31(17-23(26)29(33)38-5)7-6-30-13-18-8-19(14-30)10-20(9-18)15-30/h11-12,16-20,26H,6-10,13-15H2,1-5H3
InChIKey AMYBUBDAGUTILO-UHFFFAOYSA-N
Mol Weight 525.6 g/mol
Molecular Formula C30H39NO7
Exact Mass 525.272653 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GFoT7AuHcqV
Name 1-[2-(1-adamantyl)ethyl]-4-(3,4,5-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
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Formula C30H39NO7
InChI InChI=1S/C30H39NO7/c1-34-24-11-21(12-25(35-2)27(24)36-3)26-22(28(32)37-4)16-31(17-23(26)29(33)38-5)7-6-30-13-18-8-19(14-30)10-20(9-18)15-30/h11-12,16-20,26H,6-10,13-15H2,1-5H3
InChIKey AMYBUBDAGUTILO-UHFFFAOYSA-N
Molecular Weight 525.642 g/mol
SMILES C=1(C(C(C(=O)OC)=CN(C1)CCC12CC3CC(C2)CC(C1)C3)c1cc(OC)c(c(c1)OC)OC)C(=O)OC
SPLASH splash10-0a4i-9407010000-8ca96bbe4aff64d3ee03
Synonyms Dimethyl 1-[2-(1-adamantyl)ethyl]-4-(3,4,5-trimethoxyphenyl)-4H-pyridine-3,5-dicarboxylate
Wiley ID 1463977