![1,3-Dimethyl 2-[2-(naphthalen-1-yl)ethylidene]propanedioate](/api/spectrum/Fb8X2IKeCU0/structure.png?h=300&w=458 "1,3-Dimethyl 2-[2-(naphthalen-1-yl)ethylidene]propanedioate")
| SpectraBase Compound ID | LO0eAmIAr3t |
|---|---|
| InChI | InChI=1S/C17H16O4/c1-20-16(18)15(17(19)21-2)11-10-13-8-5-7-12-6-3-4-9-14(12)13/h3-9,11H,10H2,1-2H3 |
| InChIKey | XWYCGTUQWQTFEX-UHFFFAOYSA-N |
| Mol Weight | 284.31 g/mol |
| Molecular Formula | C17H16O4 |
| Exact Mass | 284.104859 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Fb8X2IKeCU0 |
|---|---|
| Name | 1,3-Dimethyl 2-[2-(naphthalen-1-yl)ethylidene]propanedioate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.104858991 u |
| Formula | C17H16O4 |
| InChI | InChI=1S/C17H16O4/c1-20-16(18)15(17(19)21-2)11-10-13-8-5-7-12-6-3-4-9-14(12)13/h3-9,11H,10H2,1-2H3 |
| InChIKey | XWYCGTUQWQTFEX-UHFFFAOYSA-N |
| SMILES | C1=2C(=CC=CC2)C=CC=C1CC=C(C(OC)=O)C(OC)=O |