| SpectraBase Compound ID | ChXinYumYAH |
|---|---|
| InChI | InChI=1S/C18H27NO3/c1-4-6-7-8-9-13-22-18(21)17(20)19(5-2)16-12-10-11-15(3)14-16/h10-12,14H,4-9,13H2,1-3H3 |
| InChIKey | WWKKNCYMQBTPSI-UHFFFAOYSA-N |
| Mol Weight | 305.42 g/mol |
| Molecular Formula | C18H27NO3 |
| Exact Mass | 305.199094 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6t0QjKhTjjC |
|---|---|
| Name | Oxalic acid, monoamide, N-ethyl-N-(3-methylphenyl)-, heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.199093730 u |
| Formula | C18H27NO3 |
| InChI | InChI=1S/C18H27NO3/c1-4-6-7-8-9-13-22-18(21)17(20)19(5-2)16-12-10-11-15(3)14-16/h10-12,14H,4-9,13H2,1-3H3 |
| InChIKey | WWKKNCYMQBTPSI-UHFFFAOYSA-N |
| Molecular Weight | 305.418 g/mol |
| SMILES | C(C(=O)N(CC)C1=CC(=CC=C1)C)(OCCCCCCC)=O |