| SpectraBase Compound ID | 6pFVqaEOwZK |
|---|---|
| InChI | InChI=1S/C20H21FN4O2/c1-12(2)17(19(22)26)23-20(27)18-15-5-3-4-6-16(15)25(24-18)11-13-7-9-14(21)10-8-13/h3-10,12,17H,11H2,1-2H3,(H2,22,26)(H,23,27)/t17-/m0/s1 |
| InChIKey | AKOOIMKXADOPDA-KRWDZBQOSA-N |
| Mol Weight | 368.41 g/mol |
| Molecular Formula | C20H21FN4O2 |
| Exact Mass | 368.164854 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EGJM96rXQk8 |
|---|---|
| Name | AB-FUBINACA |
| Catalog Number | 14039 |
| CAS Registry Number | 118528-00-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H21FN4O2 |
| InChI | InChI=1S/C20H21FN4O2/c1-12(2)17(19(22)26)23-20(27)18-15-5-3-4-6-16(15)25(24-18)11-13-7-9-14(21)10-8-13/h3-10,12,17H,11H2,1-2H3,(H2,22,26)(H,23,27)/t17-/m0/s1 |
| InChIKey | AKOOIMKXADOPDA-KRWDZBQOSA-N |
| Molecular Weight | 368.412 g/mol |
| SMILES | N(C(c1n[n](c2c1cccc2)Cc1ccc(cc1)F)=O)[C@](C(N)=O)(C(C)C)[H] |
| SPLASH | splash10-0pb9-2963000000-312b5ee7f7adea87dbf7 |
| Source of Spectrum | CAY-2023-1653-0 |
| Wiley ID | 1889590 |