| SpectraBase Spectrum ID |
1oZTrqeDpsk |
| Name |
1-(1-adamantylmethyl)-4-(1,3-benzodioxol-5-yl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester |
| Alternate Name(s) |
Dimethyl 1-(1-adamantylmethyl)-4-(1,3-benzodioxol-5-yl)-4H-pyridine-3,5-dicarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H31NO6 |
| InChI |
InChI=1S/C27H31NO6/c1-31-25(29)20-12-28(14-27-9-16-5-17(10-27)7-18(6-16)11-27)13-21(26(30)32-2)24(20)19-3-4-22-23(8-19)34-15-33-22/h3-4,8,12-13,16-18,24H,5-7,9-11,14-15H2,1-2H3 |
| InChIKey |
DUDQKIDUUPLHSH-UHFFFAOYSA-N |
| Molecular Weight |
465.546 g/mol |
| SMILES |
C=1(C(C(C(=O)OC)=CN(C1)CC12CC3CC(C2)CC(C1)C3)c1cc2OCOc2cc1)C(=O)OC |
| SPLASH |
splash10-0006-9404100000-91b6bd14cb82fca43372 |
| Wiley ID |
1463971 |
