![Butanedioic acid, [[(phenylmethylene)amino]methyl]-, dimethyl ester](/api/spectrum/8rlP9OhhRSe/structure.png?h=300&w=458 "Butanedioic acid, [[(phenylmethylene)amino]methyl]-, dimethyl ester")
| SpectraBase Compound ID | 1VjEeYDvTbe |
|---|---|
| InChI | InChI=1S/C14H17NO4/c1-18-13(16)8-12(14(17)19-2)10-15-9-11-6-4-3-5-7-11/h3-7,9,12H,8,10H2,1-2H3/b15-9+ |
| InChIKey | FZSRVLOKCWYCBD-OQLLNIDSSA-N |
| Mol Weight | 263.29 g/mol |
| Molecular Formula | C14H17NO4 |
| Exact Mass | 263.115758 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8rlP9OhhRSe |
|---|---|
| Name | Butanedioic acid, [[(phenylmethylene)amino]methyl]-, dimethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 263.115758027 u |
| Formula | C14H17NO4 |
| InChI | InChI=1S/C14H17NO4/c1-18-13(16)8-12(14(17)19-2)10-15-9-11-6-4-3-5-7-11/h3-7,9,12H,8,10H2,1-2H3/b15-9+ |
| InChIKey | FZSRVLOKCWYCBD-OQLLNIDSSA-N |
| Molecular Weight | 263.293 g/mol |
| SMILES | C(C(=O)OC)(CC(=O)OC)C\N=C\C=1C=CC=CC1 |