| SpectraBase Compound ID | DigYbwLxcYn |
|---|---|
| InChI | InChI=1S/C12H16N4O3/c1-9(17)14-4-6-15(7-5-14)10-2-3-12(16(18)19)11(13)8-10/h2-3,8H,4-7,13H2,1H3 |
| InChIKey | KYSIZBKIGWHFKZ-UHFFFAOYSA-N |
| Mol Weight | 264.28 g/mol |
| Molecular Formula | C12H16N4O3 |
| Exact Mass | 264.12224 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | AEoLjGg9fNB |
|---|---|
| Name | 5-(4-Acetyl-1-piperazinyl)-2-nitrophenylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.122240388 u |
| Formula | C12H16N4O3 |
| InChI | InChI=1S/C12H16N4O3/c1-9(17)14-4-6-15(7-5-14)10-2-3-12(16(18)19)11(13)8-10/h2-3,8H,4-7,13H2,1H3 |
| InChIKey | KYSIZBKIGWHFKZ-UHFFFAOYSA-N |
| Molecular Weight | 264.285 g/mol |
| SMILES | C1(N(=O)=O)=C(C=C(C=C1)N1CCN(CC1)C(=O)C)N |