![cis-4-[(Benzyloxycarbonyl)amino]cyclooctanol](/api/spectrum/L4C1u7nIylO/structure.png?h=300&w=458 "cis-4-[(Benzyloxycarbonyl)amino]cyclooctanol")
| SpectraBase Compound ID | 5VRPHaKWVE6 |
|---|---|
| InChI | InChI=1S/C16H23NO3/c18-15-9-5-4-8-14(10-11-15)17-16(19)20-12-13-6-2-1-3-7-13/h1-3,6-7,14-15,18H,4-5,8-12H2,(H,17,19)/t14-,15+/m0/s1 |
| InChIKey | PPVFMOZWOZNIAB-LSDHHAIUSA-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 | L4C1u7nIylO |
|---|---|
| Name | cis-4-[(Benzyloxycarbonyl)amino]cyclooctanol |
| 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/c18-15-9-5-4-8-14(10-11-15)17-16(19)20-12-13-6-2-1-3-7-13/h1-3,6-7,14-15,18H,4-5,8-12H2,(H,17,19)/t14-,15+/m0/s1 |
| InChIKey | PPVFMOZWOZNIAB-LSDHHAIUSA-N |
| SMILES | C(N[C@@]1(CC[C@](O)(CCCC1)[H])[H])(=O)OCC=1C=CC=CC1 |