![(3R)-1-[(3-Phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-pyrrolidinol](/api/spectrum/9xtOqD7gSlx/structure.png?h=300&w=458 "(3R)-1-[(3-Phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-pyrrolidinol")
| SpectraBase Compound ID | 8VJHNz66vO7 |
|---|---|
| InChI | InChI=1S/C13H15N3O2/c17-11-6-7-16(8-11)9-12-14-13(15-18-12)10-4-2-1-3-5-10/h1-5,11,17H,6-9H2/t11-/m1/s1 |
| InChIKey | FQHRNVUXCKTULP-LLVKDONJSA-N |
| Mol Weight | 245.28 g/mol |
| Molecular Formula | C13H15N3O2 |
| Exact Mass | 245.116427 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9xtOqD7gSlx |
|---|---|
| Name | (3R)-1-[(3-Phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-pyrrolidinol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.116426733 u |
| Formula | C13H15N3O2 |
| InChI | InChI=1S/C13H15N3O2/c17-11-6-7-16(8-11)9-12-14-13(15-18-12)10-4-2-1-3-5-10/h1-5,11,17H,6-9H2/t11-/m1/s1 |
| InChIKey | FQHRNVUXCKTULP-LLVKDONJSA-N |
| Molecular Weight | 245.282 g/mol |
| SMILES | C(C1=NC(C2=CC=CC=C2)=NO1)N1CC[C@](C1)(O)[H] |