| SpectraBase Compound ID | G5c0I2fK8WE |
|---|---|
| InChI | InChI=1S/C20H28FN3O3/c1-4-27-20(26)17(14(2)3)22-19(25)18-15-10-6-7-11-16(15)24(23-18)13-9-5-8-12-21/h6-7,10-11,14,17H,4-5,8-9,12-13H2,1-3H3,(H,22,25)/t17-/m0/s1 |
| InChIKey | YWSYUMWEKPNAHT-KRWDZBQOSA-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 | BeGICifxNvT |
|---|---|
| Name | 5-fluoro AEB |
| Catalog Number | 17735 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H28FN3O3 |
| InChI | InChI=1S/C20H28FN3O3/c1-4-27-20(26)17(14(2)3)22-19(25)18-15-10-6-7-11-16(15)24(23-18)13-9-5-8-12-21/h6-7,10-11,14,17H,4-5,8-9,12-13H2,1-3H3,(H,22,25)/t17-/m0/s1 |
| InChIKey | YWSYUMWEKPNAHT-KRWDZBQOSA-N |
| Molecular Weight | 377.460 g/mol |
| SMILES | N(C(c1c2ccccc2[n](n1)CCCCCF)=O)[C@@](C(C)C)(C(OCC)=O)[H] |
| SPLASH | splash10-0f89-2595000000-fbe2bd7583fb77a3c0a8 |
| Source of Spectrum | CAY-2023-1220-0 |
| Wiley ID | 1889165 |