| SpectraBase Compound ID | 4e80arwkP6c |
|---|---|
| InChI | InChI=1S/C24H38FN3O3Si/c1-17(2)20(23(30)31-32(6,7)24(3,4)5)26-22(29)21-18-13-9-10-14-19(18)28(27-21)16-12-8-11-15-25/h9-10,13-14,17,20H,8,11-12,15-16H2,1-7H3,(H,26,29)/t20-/m0/s1 |
| InChIKey | FNDJYNYEDFVWKB-FQEVSTJZSA-N |
| Mol Weight | 463.7 g/mol |
| Molecular Formula | C24H38FN3O3Si |
| Exact Mass | 463.266647 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FPcePILoOSw |
|---|---|
| Name | 5-Fluoro amb metabolite 7, tert-butyldimethylsilyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 463.266646791 u |
| Formula | C24H38FN3O3Si |
| InChI | InChI=1S/C24H38FN3O3Si/c1-17(2)20(23(30)31-32(6,7)24(3,4)5)26-22(29)21-18-13-9-10-14-19(18)28(27-21)16-12-8-11-15-25/h9-10,13-14,17,20H,8,11-12,15-16H2,1-7H3,(H,26,29)/t20-/m0/s1 |
| InChIKey | FNDJYNYEDFVWKB-FQEVSTJZSA-N |
| Molecular Weight | 463.669 g/mol |
| SMILES | C(N[C@@](C(C)C)(C(O[Si](C)(C)C(C)(C)C)=O)[H])(=O)C=1C2=C(C=CC=C2)N(N1)CCCCCF |