![2-Amino-3-[(2-methylpropyl)amino]naphthalene-1,4-dione](/api/spectrum/3GDpUIgudjk/structure.png?h=300&w=458 "2-Amino-3-[(2-methylpropyl)amino]naphthalene-1,4-dione")
| SpectraBase Compound ID | FmlTTkC2V4d |
|---|---|
| InChI | InChI=1S/C14H16N2O2/c1-8(2)7-16-12-11(15)13(17)9-5-3-4-6-10(9)14(12)18/h3-6,8,16H,7,15H2,1-2H3 |
| InChIKey | UAKHNMSWEQLJCW-UHFFFAOYSA-N |
| Mol Weight | 244.29 g/mol |
| Molecular Formula | C14H16N2O2 |
| Exact Mass | 244.121178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3GDpUIgudjk |
|---|---|
| Name | 2-Amino-3-[(2-methylpropyl)amino]naphthalene-1,4-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.121177761 u |
| Formula | C14H16N2O2 |
| InChI | InChI=1S/C14H16N2O2/c1-8(2)7-16-12-11(15)13(17)9-5-3-4-6-10(9)14(12)18/h3-6,8,16H,7,15H2,1-2H3 |
| InChIKey | UAKHNMSWEQLJCW-UHFFFAOYSA-N |
| Molecular Weight | 244.294 g/mol |
| SMILES | C1=CC=CC2=C1C(C(N)=C(C2=O)NCC(C)C)=O |