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1-[2-(1-adamantyloxy)ethyl]-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 8HHzUd5V2QK
InChI InChI=1S/C27H32FNO5/c1-32-25(30)22-15-29(7-8-34-27-12-17-9-18(13-27)11-19(10-17)14-27)16-23(26(31)33-2)24(22)20-3-5-21(28)6-4-20/h3-6,15-19,24H,7-14H2,1-2H3
InChIKey GVXSPPNGUINJLC-UHFFFAOYSA-N
Mol Weight 469.6 g/mol
Molecular Formula C27H32FNO5
Exact Mass 469.226451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fhdprq2JJyi
Name 1-[2-(1-adamantyloxy)ethyl]-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
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Formula C27H32FNO5
InChI InChI=1S/C27H32FNO5/c1-32-25(30)22-15-29(7-8-34-27-12-17-9-18(13-27)11-19(10-17)14-27)16-23(26(31)33-2)24(22)20-3-5-21(28)6-4-20/h3-6,15-19,24H,7-14H2,1-2H3
InChIKey GVXSPPNGUINJLC-UHFFFAOYSA-N
Molecular Weight 469.553 g/mol
SMILES C=1(C(C(C(=O)OC)=CN(C1)CCOC12CC3CC(C2)CC(C1)C3)c1ccc(cc1)F)C(=O)OC
SPLASH splash10-00g3-9714000000-d8850bdea8e0c1f3d680
Synonyms Dimethyl 1-[2-(1-adamantyloxy)ethyl]-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylate
Wiley ID 1463984