| SpectraBase Compound ID | 21qmHM7TLvh |
|---|---|
| InChI | InChI=1S/C16H31NO/c1-4-5-6-9-14(2)17(3)16(18)13-12-15-10-7-8-11-15/h14-15H,4-13H2,1-3H3 |
| InChIKey | SGTYXWOYKPXGMO-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 | CVPQqOUrvqs |
|---|---|
| Name | Propionamide, 3-cyclopentyl-N-methyl-N-(hept-2-yl)- |
| 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/c1-4-5-6-9-14(2)17(3)16(18)13-12-15-10-7-8-11-15/h14-15H,4-13H2,1-3H3 |
| InChIKey | SGTYXWOYKPXGMO-UHFFFAOYSA-N |
| Molecular Weight | 253.430 g/mol |
| SMILES | C(=O)(N(C(CCCCC)C)C)CCC1CCCC1 |