| SpectraBase Compound ID | 9YaQ7gQhsfd |
|---|---|
| InChI | InChI=1S/C18H25NO2/c1-2-9-17(16-12-7-4-8-13-16)19-18(20)21-14-15-10-5-3-6-11-15/h2-3,5-6,10-11,16-17H,1,4,7-9,12-14H2,(H,19,20)/t17-/m1/s1 |
| InChIKey | VNCUGQFZNJAGKL-QGZVFWFLSA-N |
| Mol Weight | 287.4 g/mol |
| Molecular Formula | C18H25NO2 |
| Exact Mass | 287.188529 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ESTG9V5HgKm |
|---|---|
| Name | (R)-(-)-N-benzyloxycarbonyl-1-cyclohexylbut-3-enylamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.188529047 u |
| Formula | C18H25NO2 |
| InChI | InChI=1S/C18H25NO2/c1-2-9-17(16-12-7-4-8-13-16)19-18(20)21-14-15-10-5-3-6-11-15/h2-3,5-6,10-11,16-17H,1,4,7-9,12-14H2,(H,19,20)/t17-/m1/s1 |
| InChIKey | VNCUGQFZNJAGKL-QGZVFWFLSA-N |
| Molecular Weight | 287.403 g/mol |
| SMILES | C(N[C@@](C1CCCCC1)(CC=C)[H])(=O)OCC=1C=CC=CC1 |