| SpectraBase Compound ID | BLNwaGp3I9e |
|---|---|
| InChI | InChI=1S/C16H31NO/c1-6-9-10-11-13-17(15(5)8-3)16(18)14(4)12-7-2/h7,14-15H,2,6,8-13H2,1,3-5H3 |
| InChIKey | WIQDHSJKOPRRMN-UHFFFAOYSA-N |
| Mol Weight | 253.43 g/mol |
| Molecular Formula | C16H31NO |
| Exact Mass | 253.240565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | LPeR6NLPMLN |
|---|---|
| Name | Pent-4-enoylamide, 2-methyl-N-(2-butyl)-N-hexyl- |
| 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/c1-6-9-10-11-13-17(15(5)8-3)16(18)14(4)12-7-2/h7,14-15H,2,6,8-13H2,1,3-5H3 |
| InChIKey | WIQDHSJKOPRRMN-UHFFFAOYSA-N |
| Molecular Weight | 253.430 g/mol |
| SMILES | C=CCC(C(N(C(C)CC)CCCCCC)=O)C |