| SpectraBase Compound ID | HkGjHbUsxpG |
|---|---|
| InChI | InChI=1S/C30H64N2/c1-5-9-11-13-15-17-19-21-23-26-30(31-28-25-29-32(7-3)8-4)27-24-22-20-18-16-14-12-10-6-2/h30-31H,5-29H2,1-4H3 |
| InChIKey | YXCRHVVFUBVPBC-UHFFFAOYSA-N |
| Mol Weight | 452.9 g/mol |
| Molecular Formula | C30H64N2 |
| Exact Mass | 452.50695 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4N0uIunlTCX |
|---|---|
| Name | N,N-Diethyl-N'-(12-tricosyl)-1,3-propanediamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 452.506950069 u |
| Formula | C30H64N2 |
| InChI | InChI=1S/C30H64N2/c1-5-9-11-13-15-17-19-21-23-26-30(31-28-25-29-32(7-3)8-4)27-24-22-20-18-16-14-12-10-6-2/h30-31H,5-29H2,1-4H3 |
| InChIKey | YXCRHVVFUBVPBC-UHFFFAOYSA-N |
| Molecular Weight | 452.856 g/mol |
| SMILES | N(C(CCCCCCCCCCC)CCCCCCCCCCC)CCCN(CC)CC |