| SpectraBase Compound ID | DvvAgHM5dLj |
|---|---|
| InChI | InChI=1S/C15H30N2O/c1-2-3-4-5-6-7-8-11-17-12-9-14(10-13-17)15(16)18/h14H,2-13H2,1H3,(H2,16,18) |
| InChIKey | KMWUYCUVLQVKQV-UHFFFAOYSA-N |
| Mol Weight | 254.42 g/mol |
| Molecular Formula | C15H30N2O |
| Exact Mass | 254.235814 g/mol |
| SpectraBase Spectrum ID | Hla7FqSgONv |
|---|---|
| Name | 1-Nonylisonipecotamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.235813593 u |
| Formula | C15H30N2O |
| InChI | InChI=1S/C15H30N2O/c1-2-3-4-5-6-7-8-11-17-12-9-14(10-13-17)15(16)18/h14H,2-13H2,1H3,(H2,16,18) |
| InChIKey | KMWUYCUVLQVKQV-UHFFFAOYSA-N |
| Molecular Weight | 254.418 g/mol |
| SMILES | C1CN(CCC1C(N)=O)CCCCCCCCC |
| Spectrum/Structure Validation Score (Raman) | 0.955801 |