![4-[4-(3-Methylbutanoyl)-1-piperazinyl]aniline](/api/spectrum/6VSwl7NSKVI/structure.png?h=300&w=458 "4-[4-(3-Methylbutanoyl)-1-piperazinyl]aniline")
| SpectraBase Compound ID | B3qJ0LQJI1a |
|---|---|
| InChI | InChI=1S/C15H23N3O/c1-12(2)11-15(19)18-9-7-17(8-10-18)14-5-3-13(16)4-6-14/h3-6,12H,7-11,16H2,1-2H3 |
| InChIKey | FCKWWRKXPMOIMP-UHFFFAOYSA-N |
| Mol Weight | 261.37 g/mol |
| Molecular Formula | C15H23N3O |
| Exact Mass | 261.184112 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6VSwl7NSKVI |
|---|---|
| Name | 4-[4-(3-Methylbutanoyl)-1-piperazinyl]aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.184112372 u |
| Formula | C15H23N3O |
| InChI | InChI=1S/C15H23N3O/c1-12(2)11-15(19)18-9-7-17(8-10-18)14-5-3-13(16)4-6-14/h3-6,12H,7-11,16H2,1-2H3 |
| InChIKey | FCKWWRKXPMOIMP-UHFFFAOYSA-N |
| Molecular Weight | 261.369 g/mol |
| SMILES | NC=1C=CC(N2CCN(C(CC(C)C)=O)CC2)=CC1 |