| SpectraBase Spectrum ID |
6OewymmeTXL |
| Name |
(3S,4S)-4-(4-iodophenyl)-1-methyl-3-piperidinecarboxylic acid methyl ester |
| Alternate Name(s) |
(3S,4S)-4-(4-iodophenyl)-1-methyl-nipecotic acid methyl ester
Methyl (3S,4S)-4-(4-iodophenyl)-1-methyl-piperidine-3-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18INO2 |
| InChI |
InChI=1S/C14H18INO2/c1-16-8-7-12(13(9-16)14(17)18-2)10-3-5-11(15)6-4-10/h3-6,12-13H,7-9H2,1-2H3/t12-,13-/m1/s1 |
| InChIKey |
MXCAKGCIGZRYGJ-CHWSQXEVSA-N |
| Molecular Weight |
359.207 g/mol |
| SMILES |
C1N(CC[C@@]([C@@]1(C(=O)OC)[H])(c1ccc(cc1)I)[H])C |
| SPLASH |
splash10-0006-9002000000-482fa11566fbba702c58 |
| Source of Spectrum |
F2-43-1220-13 |
| Wiley ID |
1600584 |
