| SpectraBase Compound ID | DGBM7eYp9ov |
|---|---|
| InChI | InChI=1S/C14H30N2O3S/c1-5-6-7-8-9-10-11-13(12-16(17)18)15-20(19)14(2,3)4/h13,15H,5-12H2,1-4H3/t13-,20?/m1/s1 |
| InChIKey | PKLOCCMXMVMTNX-CRIUFTBBSA-N |
| Mol Weight | 306.47 g/mol |
| Molecular Formula | C14H30N2O3S |
| Exact Mass | 306.197714 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8DmvEZc5usN |
|---|---|
| Name | (R,rs)-N-(Tert-butylsulfinyl)-1-nitrodecan-2-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.197714005 u |
| Formula | C14H30N2O3S |
| InChI | InChI=1S/C14H30N2O3S/c1-5-6-7-8-9-10-11-13(12-16(17)18)15-20(19)14(2,3)4/h13,15H,5-12H2,1-4H3/t13-,20?/m1/s1 |
| InChIKey | PKLOCCMXMVMTNX-CRIUFTBBSA-N |
| Molecular Weight | 306.465 g/mol |
| SMILES | [C@@](N[S@@](C(C)(C)C)=O)(CN(=O)=O)(CCCCCCCC)[H] |