| SpectraBase Compound ID | KZWgPACEHCc |
|---|---|
| InChI | InChI=1S/C12H18N2O2/c1-3-9-13(10-4-2)11-7-5-6-8-12(11)14(15)16/h5-8H,3-4,9-10H2,1-2H3 |
| InChIKey | FSJPCUFEJMQFEP-UHFFFAOYSA-N |
| Mol Weight | 222.29 g/mol |
| Molecular Formula | C12H18N2O2 |
| Exact Mass | 222.136828 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | pyVUhF5qDf |
|---|---|
| Name | (2-Nitrophenyl)-dipropyl-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.136827826 u |
| Formula | C12H18N2O2 |
| InChI | InChI=1S/C12H18N2O2/c1-3-9-13(10-4-2)11-7-5-6-8-12(11)14(15)16/h5-8H,3-4,9-10H2,1-2H3 |
| InChIKey | FSJPCUFEJMQFEP-UHFFFAOYSA-N |
| Molecular Weight | 222.288 g/mol |
| SMILES | C=1(N(=O)=O)C(N(CCC)CCC)=CC=CC1 |