| SpectraBase Compound ID | 4RtDBsRbgNp |
|---|---|
| InChI | InChI=1S/C14H21N3O/c15-14(18)7-4-8-16-9-11-17(12-10-16)13-5-2-1-3-6-13/h1-3,5-6H,4,7-12H2,(H2,15,18) |
| InChIKey | VCGXXWQEWBQBMU-UHFFFAOYSA-N |
| Mol Weight | 247.34 g/mol |
| Molecular Formula | C14H21N3O |
| Exact Mass | 247.168462 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8uBW3ekqXb6 |
|---|---|
| Name | 4-(Phenyl)-1-piperazinebutanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 247.168462307 u |
| Formula | C14H21N3O |
| InChI | InChI=1S/C14H21N3O/c15-14(18)7-4-8-16-9-11-17(12-10-16)13-5-2-1-3-6-13/h1-3,5-6H,4,7-12H2,(H2,15,18) |
| InChIKey | VCGXXWQEWBQBMU-UHFFFAOYSA-N |
| Molecular Weight | 247.342 g/mol |
| SMILES | C1N(CCN(C1)CCCC(=O)N)C1=CC=CC=C1 |