![Propanedioic acid, [(2-chlorophenyl)methylene]-, diethyl ester](/api/spectrum/8rzINW5Fya2/structure.png?h=300&w=458 "Propanedioic acid, [(2-chlorophenyl)methylene]-, diethyl ester")
| SpectraBase Compound ID | ALzohoVwvaD |
|---|---|
| InChI | InChI=1S/C14H15ClO4/c1-3-18-13(16)11(14(17)19-4-2)9-10-7-5-6-8-12(10)15/h5-9H,3-4H2,1-2H3 |
| InChIKey | OJWGHOBMLQZGJO-UHFFFAOYSA-N |
| Mol Weight | 282.72 g/mol |
| Molecular Formula | C14H15ClO4 |
| Exact Mass | 282.065887 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8rzINW5Fya2 |
|---|---|
| Name | Propanedioic acid, [(2-chlorophenyl)methylene]-, diethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.065886659 u |
| Formula | C14H15ClO4 |
| InChI | InChI=1S/C14H15ClO4/c1-3-18-13(16)11(14(17)19-4-2)9-10-7-5-6-8-12(10)15/h5-9H,3-4H2,1-2H3 |
| InChIKey | OJWGHOBMLQZGJO-UHFFFAOYSA-N |
| SMILES | C(=CC1=C(Cl)C=CC=C1)(C(OCC)=O)C(OCC)=O |