![3-[4-(2H-1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]propan-1-amine](/api/spectrum/5BizluVNEat/structure.png?h=300&w=458 "3-[4-(2H-1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]propan-1-amine")
| SpectraBase Compound ID | GyOQ9xd4epc |
|---|---|
| InChI | InChI=1S/C15H23N3O2/c16-4-1-5-17-6-8-18(9-7-17)11-13-2-3-14-15(10-13)20-12-19-14/h2-3,10H,1,4-9,11-12,16H2 |
| InChIKey | AVPJLKZGMWXENP-UHFFFAOYSA-N |
| Mol Weight | 277.37 g/mol |
| Molecular Formula | C15H23N3O2 |
| Exact Mass | 277.179027 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5BizluVNEat |
|---|---|
| Name | 3-[4-(2H-1,3-Benzodioxol-5-ylmethyl)piperazin-1-yl]propan-1-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.179026991 u |
| Formula | C15H23N3O2 |
| InChI | InChI=1S/C15H23N3O2/c16-4-1-5-17-6-8-18(9-7-17)11-13-2-3-14-15(10-13)20-12-19-14/h2-3,10H,1,4-9,11-12,16H2 |
| InChIKey | AVPJLKZGMWXENP-UHFFFAOYSA-N |
| SMILES | C1=CC(CN2CCN(CCCN)CC2)=CC2=C1OCO2 |