![N(1)-{2'-[(1,1'-biphenyl)-4-yl]aminoethyl}-propane-1,3-diamine](/api/spectrum/8QliBABdFo1/structure.png?h=300&w=458 "N(1)-{2'-[(1,1'-biphenyl)-4-yl]aminoethyl}-propane-1,3-diamine")
| SpectraBase Compound ID | BSF9XxfIWNh |
|---|---|
| InChI | InChI=1S/C17H23N3/c18-11-4-12-19-13-14-20-17-9-7-16(8-10-17)15-5-2-1-3-6-15/h1-3,5-10,19-20H,4,11-14,18H2 |
| InChIKey | VTHLKQXDOKULCW-UHFFFAOYSA-N |
| Mol Weight | 269.39 g/mol |
| Molecular Formula | C17H23N3 |
| Exact Mass | 269.189198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8QliBABdFo1 |
|---|---|
| Name | N(1)-{2'-[(1,1'-biphenyl)-4-yl]aminoethyl}-propane-1,3-diamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 269.189197753 u |
| Formula | C17H23N3 |
| InChI | InChI=1S/C17H23N3/c18-11-4-12-19-13-14-20-17-9-7-16(8-10-17)15-5-2-1-3-6-15/h1-3,5-10,19-20H,4,11-14,18H2 |
| InChIKey | VTHLKQXDOKULCW-UHFFFAOYSA-N |
| Molecular Weight | 269.392 g/mol |
| SMILES | C1(C=2C=CC=CC2)=CC=C(C=C1)NCCNCCCN |