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1-[2-(1-adamantyloxy)ethyl]-4-(4-hydroxy-3,5-dimethoxy-phenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID GVrtdpzrrcP
InChI InChI=1S/C29H37NO8/c1-34-23-10-20(11-24(35-2)26(23)31)25-21(27(32)36-3)15-30(16-22(25)28(33)37-4)5-6-38-29-12-17-7-18(13-29)9-19(8-17)14-29/h10-11,15-19,25,31H,5-9,12-14H2,1-4H3
InChIKey BQFQBZRWCZWWEE-UHFFFAOYSA-N
Mol Weight 527.6 g/mol
Molecular Formula C29H37NO8
Exact Mass 527.251917 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMxzotM4hUw
Name 1-[2-(1-adamantyloxy)ethyl]-4-(4-hydroxy-3,5-dimethoxy-phenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl 1-[2-(1-adamantyloxy)ethyl]-4-(3,5-dimethoxy-4-oxidanyl-phenyl)-4H-pyridine-3,5-dicarboxylate Dimethyl 1-[2-(1-adamantyloxy)ethyl]-4-(4-hydroxy-3,5-dimethoxy-phenyl)-4H-pyridine-3,5-dicarboxylate 1-[2-(1-adamantyloxy)ethyl]-4-(4-hydroxy-3,5-dimethoxyphenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
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Formula C29H37NO8
InChI InChI=1S/C29H37NO8/c1-34-23-10-20(11-24(35-2)26(23)31)25-21(27(32)36-3)15-30(16-22(25)28(33)37-4)5-6-38-29-12-17-7-18(13-29)9-19(8-17)14-29/h10-11,15-19,25,31H,5-9,12-14H2,1-4H3
InChIKey BQFQBZRWCZWWEE-UHFFFAOYSA-N
Molecular Weight 527.614 g/mol
SMILES Oc1c(cc(C2C(C(=O)OC)=CN(C=C2C(=O)OC)CCOC23CC4CC(C3)CC(C2)C4)cc1OC)OC
SPLASH splash10-054x-9401000000-1726864c86e06933255b
Wiley ID 1444725