SpectraBase Spectrum ID |
CXLfleB9yBl |
Name |
1-(1-adamantyl)-4-[4-(trifluoromethyl)phenyl]-4H-pyridine-3,5-dicarboxylic acid dimethyl ester |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C26H28F3NO4 |
InChI |
InChI=1S/C26H28F3NO4/c1-33-23(31)20-13-30(25-10-15-7-16(11-25)9-17(8-15)12-25)14-21(24(32)34-2)22(20)18-3-5-19(6-4-18)26(27,28)29/h3-6,13-17,22H,7-12H2,1-2H3/t15-,16+,17-,25- |
InChIKey |
BGOXKYHDLNTRBR-UHFFFAOYSA-N |
Molecular Weight |
475.508 g/mol |
SMILES |
C1(=CN(C23C[C@]4(C[C@@](C3)(C[C@@](C2)(C4)[H])[H])[H])C=C(C1c1ccc(C(F)(F)F)cc1)C(=O)OC)C(=O)OC |
SPLASH |
splash10-0019-6904100000-6535f525be60edb6819d |
Synonyms |
Dimethyl 1-(1-adamantyl)-4-[4-(trifluoromethyl)phenyl]-4H-pyridine-3,5-dicarboxylate |
Wiley ID |
1462875 |