| SpectraBase Compound ID | 52TDwY4j6Rv |
|---|---|
| InChI | InChI=1S/C18H23IO4/c1-4-22-17(20)16(18(21)23-5-2)12-15(11-13(3)19)14-9-7-6-8-10-14/h6-10,15-16H,3-5,11-12H2,1-2H3 |
| InChIKey | HTOCXEREYUHWBK-UHFFFAOYSA-N |
| Mol Weight | 430.28 g/mol |
| Molecular Formula | C18H23IO4 |
| Exact Mass | 430.064104 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 | JoGifOGe4Lp |
|---|---|
| Name | Diethyl 2-(4-iodo-2-phenylpent-4-en-1-yl)malonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 430.064104217 u |
| Formula | C18H23IO4 |
| InChI | InChI=1S/C18H23IO4/c1-4-22-17(20)16(18(21)23-5-2)12-15(11-13(3)19)14-9-7-6-8-10-14/h6-10,15-16H,3-5,11-12H2,1-2H3 |
| InChIKey | HTOCXEREYUHWBK-UHFFFAOYSA-N |
| Molecular Weight | 430.282 g/mol |
| SMILES | C(CC(C(OCC)=O)C(=O)OCC)(C1=CC=CC=C1)CC(I)=C |