| SpectraBase Compound ID | 45vg25SqxP8 |
|---|---|
| InChI | InChI=1S/C16H31NO/c1-5-8-13(2)11-14(3)12-15(4)16(18)17-9-6-7-10-17/h13-15H,5-12H2,1-4H3 |
| InChIKey | LLHDRZKMQVSRPZ-UHFFFAOYSA-N |
| Mol Weight | 253.43 g/mol |
| Molecular Formula | C16H31NO |
| Exact Mass | 253.240565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6snMDANVuTM |
|---|---|
| Name | N-2,4,6-Trimethylnonanoyl pyrrolidine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 253.240564621 u |
| Formula | C16H31NO |
| InChI | InChI=1S/C16H31NO/c1-5-8-13(2)11-14(3)12-15(4)16(18)17-9-6-7-10-17/h13-15H,5-12H2,1-4H3 |
| InChIKey | LLHDRZKMQVSRPZ-UHFFFAOYSA-N |
| Molecular Weight | 253.430 g/mol |
| SMILES | C(N1CCCC1)(C(CC(CC(CCC)C)C)C)=O |