| SpectraBase Compound ID | 4IixE76FbpV |
|---|---|
| InChI | InChI=1S/C14H17IO4/c1-2-18-13(16)8-5-9-14(17)19-10-11-6-3-4-7-12(11)15/h3-4,6-7H,2,5,8-10H2,1H3 |
| InChIKey | ZHUTXPICLQVVLY-UHFFFAOYSA-N |
| Mol Weight | 376.19 g/mol |
| Molecular Formula | C14H17IO4 |
| Exact Mass | 376.017154 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 | EUNdSjFMW5u |
|---|---|
| Name | Glutaric acid, ethyl 2-iodobenzyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 376.017154023 u |
| Formula | C14H17IO4 |
| InChI | InChI=1S/C14H17IO4/c1-2-18-13(16)8-5-9-14(17)19-10-11-6-3-4-7-12(11)15/h3-4,6-7H,2,5,8-10H2,1H3 |
| InChIKey | ZHUTXPICLQVVLY-UHFFFAOYSA-N |
| Molecular Weight | 376.190 g/mol |
| SMILES | C(OCC1=C(C=CC=C1)I)(=O)CCCC(OCC)=O |