| SpectraBase Compound ID | 1qwdwqvayIE |
|---|---|
| InChI | InChI=1S/C22H40N2/c1-3-5-7-9-11-13-19-23-21-15-17-22(18-16-21)24-20-14-12-10-8-6-4-2/h15-18,23-24H,3-14,19-20H2,1-2H3 |
| InChIKey | DFNXHHNFURNWAF-UHFFFAOYSA-N |
| Mol Weight | 332.6 g/mol |
| Molecular Formula | C22H40N2 |
| Exact Mass | 332.319149 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 840x6I42W40 |
|---|---|
| Name | 1-N,4-N-Dioctylbenzene-1,4-diamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.319149296 u |
| Formula | C22H40N2 |
| InChI | InChI=1S/C22H40N2/c1-3-5-7-9-11-13-19-23-21-15-17-22(18-16-21)24-20-14-12-10-8-6-4-2/h15-18,23-24H,3-14,19-20H2,1-2H3 |
| InChIKey | DFNXHHNFURNWAF-UHFFFAOYSA-N |
| Molecular Weight | 332.576 g/mol |
| SMILES | C1(NCCCCCCCC)=CC=C(C=C1)NCCCCCCCC |