| SpectraBase Compound ID | 9lcE3HdSWIy |
|---|---|
| InChI | InChI=1S/C18H30BrN/c1-3-5-9-14-20(15-10-6-4-2)16-13-17-11-7-8-12-18(17)19/h7-8,11-12H,3-6,9-10,13-16H2,1-2H3 |
| InChIKey | ROGABTDFBDHZQM-UHFFFAOYSA-N |
| Mol Weight | 340.35 g/mol |
| Molecular Formula | C18H30BrN |
| Exact Mass | 339.156163 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DgUJPjVl8H7 |
|---|---|
| Name | N,N-Dipentyl-2-bromophenethylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 339.156162970 u |
| Formula | C18H30BrN |
| InChI | InChI=1S/C18H30BrN/c1-3-5-9-14-20(15-10-6-4-2)16-13-17-11-7-8-12-18(17)19/h7-8,11-12H,3-6,9-10,13-16H2,1-2H3 |
| InChIKey | ROGABTDFBDHZQM-UHFFFAOYSA-N |
| Molecular Weight | 340.349 g/mol |
| SMILES | C=1(C(=CC=CC1)Br)CCN(CCCCC)CCCCC |