SpectraBase Spectrum ID |
QA7uccxTU |
Name |
1-(1-adamantylmethyl)-4-(3-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H30FNO4 |
InChI |
InChI=1S/C26H30FNO4/c1-31-24(29)21-13-28(15-26-10-16-6-17(11-26)8-18(7-16)12-26)14-22(25(30)32-2)23(21)19-4-3-5-20(27)9-19/h3-5,9,13-14,16-18,23H,6-8,10-12,15H2,1-2H3 |
InChIKey |
ADSGHFOESBLZOI-UHFFFAOYSA-N |
Molecular Weight |
439.527 g/mol |
SMILES |
C=1(C(C(C(=O)OC)=CN(C1)CC12CC3CC(C2)CC(C1)C3)c1cc(F)ccc1)C(=O)OC |
SPLASH |
splash10-0007-9604000000-f4f81252788daa56ea44 |
Synonyms |
Dimethyl 1-(1-adamantylmethyl)-4-(3-fluorophenyl)-4H-pyridine-3,5-dicarboxylate |
Wiley ID |
1443571 |