| SpectraBase Compound ID | Bfh07WHdwF8 |
|---|---|
| InChI | InChI=1S/C16H28N2/c1-3-5-7-13-17-15-9-11-16(12-10-15)18-14-8-6-4-2/h9-12,17-18H,3-8,13-14H2,1-2H3 |
| InChIKey | KBZCJWFXUATLMS-UHFFFAOYSA-N |
| Mol Weight | 248.41 g/mol |
| Molecular Formula | C16H28N2 |
| Exact Mass | 248.225249 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HtAUUFO2VaU |
|---|---|
| Name | N,N'-Dipentylbenzene-1,4-diamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 248.225248910 u |
| Formula | C16H28N2 |
| InChI | InChI=1S/C16H28N2/c1-3-5-7-13-17-15-9-11-16(12-10-15)18-14-8-6-4-2/h9-12,17-18H,3-8,13-14H2,1-2H3 |
| InChIKey | KBZCJWFXUATLMS-UHFFFAOYSA-N |
| Molecular Weight | 248.414 g/mol |
| SMILES | C=1C=C(C=CC1NCCCCC)NCCCCC |