| SpectraBase Compound ID | 7vGYPfepGrE |
|---|---|
| InChI | InChI=1S/C27H48BrN/c1-3-5-7-9-11-13-15-17-23-29(25-26-19-21-27(28)22-20-26)24-18-16-14-12-10-8-6-4-2/h19-22H,3-18,23-25H2,1-2H3 |
| InChIKey | LTHILJJEPDKFNM-UHFFFAOYSA-N |
| Mol Weight | 466.6 g/mol |
| Molecular Formula | C27H48BrN |
| Exact Mass | 465.297014 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5EzjqqiIBcM |
|---|---|
| Name | 4-Bromobenzylamine, N,N-didecyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 465.297013550 u |
| Formula | C27H48BrN |
| InChI | InChI=1S/C27H48BrN/c1-3-5-7-9-11-13-15-17-23-29(25-26-19-21-27(28)22-20-26)24-18-16-14-12-10-8-6-4-2/h19-22H,3-18,23-25H2,1-2H3 |
| InChIKey | LTHILJJEPDKFNM-UHFFFAOYSA-N |
| Molecular Weight | 466.592 g/mol |
| SMILES | C1(=CC=C(C=C1)CN(CCCCCCCCCC)CCCCCCCCCC)Br |