| SpectraBase Compound ID | LX7uVg4wh |
|---|---|
| InChI | InChI=1S/C16H31NO/c1-5-8-9-10-11-14-17(13-7-3)16(18)15(4)12-6-2/h6,15H,2,5,7-14H2,1,3-4H3 |
| InChIKey | HLHSFAJCRGFZTC-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 | 1f2BB9SHBAM |
|---|---|
| Name | Pent-4-enoylamide, 2-methyl-N-propyl-N-heptyl- |
| 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/c1-5-8-9-10-11-14-17(13-7-3)16(18)15(4)12-6-2/h6,15H,2,5,7-14H2,1,3-4H3 |
| InChIKey | HLHSFAJCRGFZTC-UHFFFAOYSA-N |
| Molecular Weight | 253.430 g/mol |
| SMILES | C(N(CCC)CCCCCCC)(=O)C(CC=C)C |