| SpectraBase Compound ID | 99Yf48CLBtg |
|---|---|
| InChI | InChI=1S/C15H22BrNO/c1-3-4-5-6-11-17-12(2)15(18)13-7-9-14(16)10-8-13/h7-10,12,17H,3-6,11H2,1-2H3 |
| InChIKey | HSPGFGFWRGLJFH-UHFFFAOYSA-N |
| Mol Weight | 312.25 g/mol |
| Molecular Formula | C15H22BrNO |
| Exact Mass | 311.088477 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 88WqJFf9YwM |
|---|---|
| Name | N-Hexyl-4-bromocathinone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.088477331 u |
| Formula | C15H22BrNO |
| InChI | InChI=1S/C15H22BrNO/c1-3-4-5-6-11-17-12(2)15(18)13-7-9-14(16)10-8-13/h7-10,12,17H,3-6,11H2,1-2H3 |
| InChIKey | HSPGFGFWRGLJFH-UHFFFAOYSA-N |
| Molecular Weight | 312.251 g/mol |
| SMILES | C(C=1C=CC(=CC1)Br)(C(NCCCCCC)C)=O |