| SpectraBase Compound ID | IViXFE3BM7i |
|---|---|
| InChI | InChI=1S/C15H19NO3/c1-4-9-19-15(18)8-7-14(17)16-13-6-5-11(2)12(3)10-13/h5-8,10H,4,9H2,1-3H3,(H,16,17)/b8-7+ |
| InChIKey | FFNGTJFJDOVTGA-BQYQJAHWSA-N |
| Mol Weight | 261.32 g/mol |
| Molecular Formula | C15H19NO3 |
| Exact Mass | 261.136493 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 | 1Rd2LTbojmp |
|---|---|
| Name | Fumaric acid, monoamide, N-(3,4-dimethylphenyl)-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.136493473 u |
| Formula | C15H19NO3 |
| InChI | InChI=1S/C15H19NO3/c1-4-9-19-15(18)8-7-14(17)16-13-6-5-11(2)12(3)10-13/h5-8,10H,4,9H2,1-3H3,(H,16,17)/b8-7+ |
| InChIKey | FFNGTJFJDOVTGA-BQYQJAHWSA-N |
| Molecular Weight | 261.321 g/mol |
| SMILES | C(\C=C\C(NC1=CC=C(C)C(C)=C1)=O)(OCCC)=O |