| SpectraBase Compound ID | LKCnsj0nV5S |
|---|---|
| InChI | InChI=1S/C20H28FN3O3/c1-20(2,3)17(19(26)27-4)22-18(25)16-14-10-6-7-11-15(14)24(23-16)13-9-5-8-12-21/h6-7,10-11,17H,5,8-9,12-13H2,1-4H3,(H,22,25)/t17-/m1/s1 |
| InChIKey | PWEKNGSNNAKWBL-QGZVFWFLSA-N |
| Mol Weight | 377.46 g/mol |
| Molecular Formula | C20H28FN3O3 |
| Exact Mass | 377.21147 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5Cvu3l0DcEI |
|---|---|
| Name | (S)-5-fluoro ADB |
| Catalog Number | 23631 |
| CAS Registry Number | 1971007-89-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H28FN3O3 |
| InChI | InChI=1S/C20H28FN3O3/c1-20(2,3)17(19(26)27-4)22-18(25)16-14-10-6-7-11-15(14)24(23-16)13-9-5-8-12-21/h6-7,10-11,17H,5,8-9,12-13H2,1-4H3,(H,22,25)/t17-/m1/s1 |
| InChIKey | PWEKNGSNNAKWBL-QGZVFWFLSA-N |
| Molecular Weight | 377.460 g/mol |
| SMILES | N(C(=O)c1n[n](CCCCCF)c2c1cccc2)[C@](C(OC)=O)(C(C)(C)C)[H] |
| SPLASH | splash10-001i-2692000000-05d578b4b5ec754524d3 |
| Source of Spectrum | CAY-2023-2117-0 |
| Wiley ID | 1890053 |