| SpectraBase Compound ID | i6E4nwZOw6 |
|---|---|
| InChI | InChI=1S/C21H28F2N4O2/c1-21(2,3)18(19(24)28)25-20(29)17-13-16(14-7-9-15(23)10-8-14)26-27(17)12-6-4-5-11-22/h7-10,13,18H,4-6,11-12H2,1-3H3,(H2,24,28)(H,25,29) |
| InChIKey | CMXMZASHZSECQV-UHFFFAOYSA-N |
| Mol Weight | 406.48 g/mol |
| Molecular Formula | C21H28F2N4O2 |
| Exact Mass | 406.218032 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AaD89HuJ2EF |
|---|---|
| Name | 5-fluoro 3,5-ADB-PFUPPYCA |
| Catalog Number | 18530 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H28F2N4O2 |
| InChI | InChI=1S/C21H28F2N4O2/c1-21(2,3)18(19(24)28)25-20(29)17-13-16(14-7-9-15(23)10-8-14)26-27(17)12-6-4-5-11-22/h7-10,13,18H,4-6,11-12H2,1-3H3,(H2,24,28)(H,25,29) |
| InChIKey | CMXMZASHZSECQV-UHFFFAOYSA-N |
| Molecular Weight | 406.478 g/mol |
| SMILES | N(C(c1[n](nc(c1)-c1ccc(cc1)F)CCCCCF)=O)C(C(=O)N)C(C)(C)C |
| SPLASH | splash10-02ej-7983000000-c424aa85d53b9302f711 |
| Source of Spectrum | CAY-2023-1193-0 |
| Wiley ID | 1889146 |