| SpectraBase Compound ID | 1hzf2MECZnC |
|---|---|
| InChI | InChI=1S/C17H25NO2/c1-4-6-8-13-16(19)18(3)15(5-2)17(20)14-11-9-7-10-12-14/h7,9-12,15H,4-6,8,13H2,1-3H3 |
| InChIKey | GFDLDJAGNPZBCP-UHFFFAOYSA-N |
| Mol Weight | 275.39 g/mol |
| Molecular Formula | C17H25NO2 |
| Exact Mass | 275.188529 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CRLqsC0RtrF |
|---|---|
| Name | Buphedrone hex |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 275.188529047 u |
| Formula | C17H25NO2 |
| InChI | InChI=1S/C17H25NO2/c1-4-6-8-13-16(19)18(3)15(5-2)17(20)14-11-9-7-10-12-14/h7,9-12,15H,4-6,8,13H2,1-3H3 |
| InChIKey | GFDLDJAGNPZBCP-UHFFFAOYSA-N |
| Molecular Weight | 275.392 g/mol |
| SMILES | C(C(C1=CC=CC=C1)=O)(N(C(CCCCC)=O)C)CC |