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1-[2-(1-adamantyloxy)ethyl]-4-(2-isopropoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 93lXT0op1n4
InChI InChI=1S/C30H39NO6/c1-19(2)37-26-8-6-5-7-23(26)27-24(28(32)34-3)17-31(18-25(27)29(33)35-4)9-10-36-30-14-20-11-21(15-30)13-22(12-20)16-30/h5-8,17-22,27H,9-16H2,1-4H3
InChIKey SUHJNBIBSNEJQH-UHFFFAOYSA-N
Mol Weight 509.6 g/mol
Molecular Formula C30H39NO6
Exact Mass 509.277738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbVFlByCx2m
Name 1-[2-(1-adamantyloxy)ethyl]-4-(2-isopropoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
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Formula C30H39NO6
InChI InChI=1S/C30H39NO6/c1-19(2)37-26-8-6-5-7-23(26)27-24(28(32)34-3)17-31(18-25(27)29(33)35-4)9-10-36-30-14-20-11-21(15-30)13-22(12-20)16-30/h5-8,17-22,27H,9-16H2,1-4H3
InChIKey SUHJNBIBSNEJQH-UHFFFAOYSA-N
Molecular Weight 509.643 g/mol
SMILES C=1(C(C(C(=O)OC)=CN(C1)CCOC12CC3CC(C2)CC(C1)C3)c1c(OC(C)C)cccc1)C(=O)OC
SPLASH splash10-0006-9512600000-7f5780ff9f89421b5d62
Synonyms 1-[2-(1-adamantyloxy)ethyl]-4-(2-propan-2-yloxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Dimethyl 1-[2-(1-adamantyloxy)ethyl]-4-(2-isopropoxyphenyl)-4H-pyridine-3,5-dicarboxylate Dimethyl 1-[2-(1-adamantyloxy)ethyl]-4-(2-propan-2-yloxyphenyl)-4H-pyridine-3,5-dicarboxylate
Wiley ID 1444741