| SpectraBase Compound ID | LKIlZlmKKY3 |
|---|---|
| InChI | InChI=1S/C18H35NO3/c1-4-7-10-11-12-13-16-22-18(21)17(20)19(14-8-5-2)15-9-6-3/h4-16H2,1-3H3 |
| InChIKey | JGCYYZYZKOQTJP-UHFFFAOYSA-N |
| Mol Weight | 313.5 g/mol |
| Molecular Formula | C18H35NO3 |
| Exact Mass | 313.261694 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8VooJnl1E79 |
|---|---|
| Name | Oxalic acid, monoamide, N,N-dibutyl, octyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 313.261693988 u |
| Formula | C18H35NO3 |
| InChI | InChI=1S/C18H35NO3/c1-4-7-10-11-12-13-16-22-18(21)17(20)19(14-8-5-2)15-9-6-3/h4-16H2,1-3H3 |
| InChIKey | JGCYYZYZKOQTJP-UHFFFAOYSA-N |
| SMILES | C(N(C(C(OCCCCCCCC)=O)=O)CCCC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.958608 |