| SpectraBase Compound ID | 9d2UrllgnJd |
|---|---|
| InChI | InChI=1S/C15H21BrN2O2/c1-15(2,3)20-14(19)18-9-7-17(8-10-18)13-6-4-5-12(16)11-13/h4-6,11H,7-10H2,1-3H3 |
| InChIKey | DVJZPRQEOHFPQO-UHFFFAOYSA-N |
| Mol Weight | 341.25 g/mol |
| Molecular Formula | C15H21BrN2O2 |
| Exact Mass | 340.078641 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5xP1wuJz1FP |
|---|---|
| Name | 1-boc-4-(3-Bromophenyl)piperazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.078640922 u |
| Formula | C15H21BrN2O2 |
| InChI | InChI=1S/C15H21BrN2O2/c1-15(2,3)20-14(19)18-9-7-17(8-10-18)13-6-4-5-12(16)11-13/h4-6,11H,7-10H2,1-3H3 |
| InChIKey | DVJZPRQEOHFPQO-UHFFFAOYSA-N |
| Molecular Weight | 341.249 g/mol |
| SMILES | C1(Br)=CC(N2CCN(CC2)C(OC(C)(C)C)=O)=CC=C1 |