| SpectraBase Compound ID | 4zdwFZocV4D |
|---|---|
| InChI | InChI=1S/C13H20N4O4/c1-3-15(4-2)9-5-8-14-12-7-6-11(16(18)19)10-13(12)17(20)21/h6-7,10,14H,3-5,8-9H2,1-2H3 |
| InChIKey | KXNXVNDHDPJZSD-UHFFFAOYSA-N |
| Mol Weight | 296.33 g/mol |
| Molecular Formula | C13H20N4O4 |
| Exact Mass | 296.148455 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FjnnGapWqZ7 |
|---|---|
| Name | N,N-Diethyl-N'-(2,4-dinitrophenyl)-1,3-propanediamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.148455136 u |
| Formula | C13H20N4O4 |
| InChI | InChI=1S/C13H20N4O4/c1-3-15(4-2)9-5-8-14-12-7-6-11(16(18)19)10-13(12)17(20)21/h6-7,10,14H,3-5,8-9H2,1-2H3 |
| InChIKey | KXNXVNDHDPJZSD-UHFFFAOYSA-N |
| Molecular Weight | 296.327 g/mol |
| SMILES | N(C=1C=CC(=CC1N(=O)=O)N(=O)=O)CCCN(CC)CC |