| SpectraBase Compound ID | A6yJGFlght5 |
|---|---|
| InChI | InChI=1S/C8H7IO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3 |
| InChIKey | DYUWQWMXZHDZOR-UHFFFAOYSA-N |
| Mol Weight | 262.05 g/mol |
| Molecular Formula | C8H7IO2 |
| Exact Mass | 261.949074 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AZnuDRqYTi0 |
|---|---|
| Name | 4-Iodobenzoic acid, methyl ester |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H7IO2 |
| InChI | InChI=1S/C8H7IO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3 |
| InChIKey | DYUWQWMXZHDZOR-UHFFFAOYSA-N |
| Molecular Weight | 261.9448 |
| SMILES | c1(I)ccc(C(OC)=O)cc1 |
| SPLASH | splash10-02w9-9050000000-b9b25f9459a08c9a2ed3 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |