| SpectraBase Compound ID | 7bc0iEbyJ14 |
|---|---|
| InChI | InChI=1S/C15H29N/c1-3-5-6-8-14-10-12-15-11-9-13(7-4-2)16(14)15/h13-15H,3-12H2,1-2H3 |
| InChIKey | TUOZKLHXIPOIJR-UHFFFAOYSA-N |
| Mol Weight | 223.4 g/mol |
| Molecular Formula | C15H29N |
| Exact Mass | 223.23 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DNinvb15BPX |
|---|---|
| Name | (3S,5R,7as)-3-Pentyl-5-propylhexahydro-1H-pyrrolizine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.229999938 u |
| Formula | C15H29N |
| InChI | InChI=1S/C15H29N/c1-3-5-6-8-14-10-12-15-11-9-13(7-4-2)16(14)15/h13-15H,3-12H2,1-2H3 |
| InChIKey | TUOZKLHXIPOIJR-UHFFFAOYSA-N |
| Molecular Weight | 223.404 g/mol |
| SMILES | C1C(N2C(CCC2C1)CCCCC)CCC |