| SpectraBase Compound ID | AB89ywvkHNK |
|---|---|
| InChI | InChI=1S/C17H25NO3/c1-2-3-10-15-16(19)11-7-12-18(15)17(20)21-13-14-8-5-4-6-9-14/h4-6,8-9,15-16,19H,2-3,7,10-13H2,1H3/t15-,16-/m1/s1 |
| InChIKey | SMUYGMGIWIZLTE-HZPDHXFCSA-N |
| Mol Weight | 291.39 g/mol |
| Molecular Formula | C17H25NO3 |
| Exact Mass | 291.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Qa40QPVBzM |
|---|---|
| Name | (R,R)-1-(Benzyloxycarbonyl)-2-butylpiperidine-3-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.183443666 u |
| Formula | C17H25NO3 |
| InChI | InChI=1S/C17H25NO3/c1-2-3-10-15-16(19)11-7-12-18(15)17(20)21-13-14-8-5-4-6-9-14/h4-6,8-9,15-16,19H,2-3,7,10-13H2,1H3/t15-,16-/m1/s1 |
| InChIKey | SMUYGMGIWIZLTE-HZPDHXFCSA-N |
| SMILES | C(N1[C@@]([C@](O)(CCC1)[H])(CCCC)[H])(OCC=1C=CC=CC1)=O |