| SpectraBase Compound ID | 7YOLcJcH1ZK |
|---|---|
| InChI | InChI=1S/C20H27FN2O3/c1-4-26-20(25)18(14(2)3)22-19(24)16-13-23(12-8-7-11-21)17-10-6-5-9-15(16)17/h5-6,9-10,13-14,18H,4,7-8,11-12H2,1-3H3,(H,22,24)/t18-/m0/s1 |
| InChIKey | YRVNWHXSMRQPFR-SFHVURJKSA-N |
| Mol Weight | 362.45 g/mol |
| Molecular Formula | C20H27FN2O3 |
| Exact Mass | 362.200571 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EkIgoGLFx5o |
|---|---|
| Name | 4-fluoro EMB-BUTICA |
| Catalog Number | 31298 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H27FN2O3 |
| InChI | InChI=1S/C20H27FN2O3/c1-4-26-20(25)18(14(2)3)22-19(24)16-13-23(12-8-7-11-21)17-10-6-5-9-15(16)17/h5-6,9-10,13-14,18H,4,7-8,11-12H2,1-3H3,(H,22,24)/t18-/m0/s1 |
| InChIKey | YRVNWHXSMRQPFR-SFHVURJKSA-N |
| Molecular Weight | 362.445 g/mol |
| SMILES | N(C(=O)c1c[n](CCCCF)c2c1cccc2)[C@](C(OCC)=O)(C(C)C)[H] |
| SPLASH | splash10-014i-0490000000-02cae4986473b4692028 |
| Source of Spectrum | CAY-2023-184-0 |
| Wiley ID | 1888150 |