| SpectraBase Compound ID | BdZbrMoNfEZ |
|---|---|
| InChI | InChI=1S/C13H27NO2/c1-4-6-7-8-9-10-11-14-13(15)16-12(3)5-2/h12H,4-11H2,1-3H3,(H,14,15)/t12-/m0/s1 |
| InChIKey | XMMQWJBITCRSPG-LBPRGKRZSA-N |
| Mol Weight | 229.36 g/mol |
| Molecular Formula | C13H27NO2 |
| Exact Mass | 229.204179 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IFRlGNHqhw |
|---|---|
| Name | (S)-(+)-N-octyl-2-butyl carbamate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 229.204179111 u |
| Formula | C13H27NO2 |
| InChI | InChI=1S/C13H27NO2/c1-4-6-7-8-9-10-11-14-13(15)16-12(3)5-2/h12H,4-11H2,1-3H3,(H,14,15)/t12-/m0/s1 |
| InChIKey | XMMQWJBITCRSPG-LBPRGKRZSA-N |
| Molecular Weight | 229.364 g/mol |
| SMILES | C(=O)(O[C@](CC)(C)[H])NCCCCCCCC |