| SpectraBase Compound ID | L1Ra75OOcFl |
|---|---|
| InChI | InChI=1S/C22H29FN4O2/c1-14(2)20(21(24)28)25-22(29)19-12-18(16-8-10-17(23)11-9-16)26-27(19)13-15-6-4-3-5-7-15/h8-12,14-15,20H,3-7,13H2,1-2H3,(H2,24,28)(H,25,29)/t20-/m0/s1 |
| InChIKey | NDYOOVJIZQTGHY-FQEVSTJZSA-N |
| Mol Weight | 400.5 g/mol |
| Molecular Formula | C22H29FN4O2 |
| Exact Mass | 400.227454 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JHxLUBIhSlP |
|---|---|
| Name | 3,5-AB-CHMFUPPYCA |
| Catalog Number | 18204 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H29FN4O2 |
| InChI | InChI=1S/C22H29FN4O2/c1-14(2)20(21(24)28)25-22(29)19-12-18(16-8-10-17(23)11-9-16)26-27(19)13-15-6-4-3-5-7-15/h8-12,14-15,20H,3-7,13H2,1-2H3,(H2,24,28)(H,25,29)/t20-/m0/s1 |
| InChIKey | NDYOOVJIZQTGHY-FQEVSTJZSA-N |
| Molecular Weight | 400.498 g/mol |
| SMILES | N(C(=O)c1[n](nc(c1)-c1ccc(cc1)F)CC1CCCCC1)[C@](C(=O)N)(C(C)C)[H] |
| SPLASH | splash10-0a4i-4690000000-7b88bd31d150fc35547b |
| Source of Spectrum | CAY-2023-1275-0 |
| Wiley ID | 1889212 |