![1-(Benzo[D][1,3]dioxol-5-yl)-2-(pyrrolidin-1-yl)pentan-1-ol](/api/spectrum/HoFM82HhVdH/structure.png?h=300&w=458 "1-(Benzo[D][1,3]dioxol-5-yl)-2-(pyrrolidin-1-yl)pentan-1-ol")
| SpectraBase Compound ID | K8l4OFswmBm |
|---|---|
| InChI | InChI=1S/C16H23NO3/c1-2-5-13(17-8-3-4-9-17)16(18)12-6-7-14-15(10-12)20-11-19-14/h6-7,10,13,16,18H,2-5,8-9,11H2,1H3 |
| InChIKey | UIWFLVUPDFXFEB-UHFFFAOYSA-N |
| Mol Weight | 277.36 g/mol |
| Molecular Formula | C16H23NO3 |
| Exact Mass | 277.167794 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HoFM82HhVdH |
|---|---|
| Name | 1-(Benzo[D][1,3]dioxol-5-yl)-2-(pyrrolidin-1-yl)pentan-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.167793602 u |
| Formula | C16H23NO3 |
| InChI | InChI=1S/C16H23NO3/c1-2-5-13(17-8-3-4-9-17)16(18)12-6-7-14-15(10-12)20-11-19-14/h6-7,10,13,16,18H,2-5,8-9,11H2,1H3 |
| InChIKey | UIWFLVUPDFXFEB-UHFFFAOYSA-N |
| SMILES | C1(C(C(N2CCCC2)CCC)O)=CC2=C(C=C1)OCO2 |