![N(1),N(1)-Diethyl-N(4)-[3,4-dimethoxyphenyl]-1,4-pentanediamine](/api/spectrum/7tiopVQE4E2/structure.png?h=300&w=458 "N(1),N(1)-Diethyl-N(4)-[3,4-dimethoxyphenyl]-1,4-pentanediamine")
| SpectraBase Compound ID | J5KvfeuI91O |
|---|---|
| InChI | InChI=1S/C17H30N2O2/c1-6-19(7-2)12-8-9-14(3)18-15-10-11-16(20-4)17(13-15)21-5/h10-11,13-14,18H,6-9,12H2,1-5H3 |
| InChIKey | OOBOKVZOUBMBMT-UHFFFAOYSA-N |
| Mol Weight | 294.44 g/mol |
| Molecular Formula | C17H30N2O2 |
| Exact Mass | 294.230728 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7tiopVQE4E2 |
|---|---|
| Name | N(1),N(1)-Diethyl-N(4)-[3,4-dimethoxyphenyl]-1,4-pentanediamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 294.230728212 u |
| Formula | C17H30N2O2 |
| InChI | InChI=1S/C17H30N2O2/c1-6-19(7-2)12-8-9-14(3)18-15-10-11-16(20-4)17(13-15)21-5/h10-11,13-14,18H,6-9,12H2,1-5H3 |
| InChIKey | OOBOKVZOUBMBMT-UHFFFAOYSA-N |
| SMILES | C1(=CC=C(C(=C1)OC)OC)NC(CCCN(CC)CC)C |