| SpectraBase Compound ID | GIIaf2Rqrt0 |
|---|---|
| InChI | InChI=1S/C21H24N4O2/c1-2-3-13-25-18-12-8-7-11-16(18)19(24-25)21(27)23-17(20(22)26)14-15-9-5-4-6-10-15/h4-12,17H,2-3,13-14H2,1H3,(H2,22,26)(H,23,27)/t17-/m0/s1 |
| InChIKey | OYARCJMQMAFMTG-KRWDZBQOSA-N |
| Mol Weight | 364.45 g/mol |
| Molecular Formula | C21H24N4O2 |
| Exact Mass | 364.189926 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1L5aqkE0cei |
|---|---|
| Name | APP-BUTINACA |
| Catalog Number | 26905 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H24N4O2 |
| InChI | InChI=1S/C21H24N4O2/c1-2-3-13-25-18-12-8-7-11-16(18)19(24-25)21(27)23-17(20(22)26)14-15-9-5-4-6-10-15/h4-12,17H,2-3,13-14H2,1H3,(H2,22,26)(H,23,27)/t17-/m0/s1 |
| InChIKey | OYARCJMQMAFMTG-KRWDZBQOSA-N |
| Molecular Weight | 364.449 g/mol |
| SMILES | N(C(c1c2c([n](n1)CCCC)cccc2)=O)[C@](C(N)=O)(Cc1ccccc1)[H] |
| SPLASH | splash10-0udi-4692000000-ca435b24580bb01f1bca |
| Source of Spectrum | CAY-2023-507-0 |
| Wiley ID | 1888468 |