| SpectraBase Compound ID | 7EBZaOjvxLD |
|---|---|
| InChI | InChI=1S/C25H44ClN/c1-3-5-7-9-11-13-15-21-27(22-16-14-12-10-8-6-4-2)23-24-17-19-25(26)20-18-24/h17-20H,3-16,21-23H2,1-2H3 |
| InChIKey | XNHRFIDCNLINDT-UHFFFAOYSA-N |
| Mol Weight | 394.1 g/mol |
| Molecular Formula | C25H44ClN |
| Exact Mass | 393.316228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DDCTCfL1dlu |
|---|---|
| Name | 4-Chlorobenzylamine, N,N-dinonyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 393.316228121 u |
| Formula | C25H44ClN |
| InChI | InChI=1S/C25H44ClN/c1-3-5-7-9-11-13-15-21-27(22-16-14-12-10-8-6-4-2)23-24-17-19-25(26)20-18-24/h17-20H,3-16,21-23H2,1-2H3 |
| InChIKey | XNHRFIDCNLINDT-UHFFFAOYSA-N |
| Molecular Weight | 394.087 g/mol |
| SMILES | C1(=CC=C(C=C1)CN(CCCCCCCCC)CCCCCCCCC)Cl |