![threo-N-[3-(p-chlorophenyl)-3-hydroxy-2-methylpropanoyl]pyrrolidine](/api/spectrum/LpX48I0FOpd/structure.png?h=300&w=458 "threo-N-[3-(p-chlorophenyl)-3-hydroxy-2-methylpropanoyl]pyrrolidine")
| SpectraBase Compound ID | 8CBndzBUEw |
|---|---|
| InChI | InChI=1S/C14H18ClNO2/c1-10(14(18)16-8-2-3-9-16)13(17)11-4-6-12(15)7-5-11/h4-7,10,13,17H,2-3,8-9H2,1H3 |
| InChIKey | IXJFJBNDDWPBTA-UHFFFAOYSA-N |
| Mol Weight | 267.76 g/mol |
| Molecular Formula | C14H18ClNO2 |
| Exact Mass | 267.102607 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LpX48I0FOpd |
|---|---|
| Name | Threo-N-[3-(p-chlorophenyl)-3-hydroxy-2-methylpropanoyl]pyrrolidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.102606522 u |
| Formula | C14H18ClNO2 |
| InChI | InChI=1S/C14H18ClNO2/c1-10(14(18)16-8-2-3-9-16)13(17)11-4-6-12(15)7-5-11/h4-7,10,13,17H,2-3,8-9H2,1H3 |
| InChIKey | IXJFJBNDDWPBTA-UHFFFAOYSA-N |
| SMILES | C(C(C(C1=CC=C(C=C1)Cl)O)C)(N1CCCC1)=O |