| SpectraBase Compound ID | AwyWDb0mbNi |
|---|---|
| InChI | InChI=1S/C8H7IO2/c1-5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11) |
| InChIKey | WNVUYAMRIXEZAT-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 | 3wWEoptNRif |
|---|---|
| Name | 2-iodo-4-methylbenzoic acid |
| CAS Registry Number | 1829-21-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7IO2 |
| InChI | InChI=1S/C8H7IO2/c1-5-2-3-6(8(10)11)7(9)4-5/h2-4H,1H3,(H,10,11) |
| InChIKey | WNVUYAMRIXEZAT-UHFFFAOYSA-N |
| Molecular Weight | 262.046 g/mol |
| SMILES | OC(c1c(cc(C)cc1)I)=O |
| SPLASH | splash10-03g1-9340000000-8d645988ef798f53aa3d |
| Source of Spectrum | AD-0-2532-0 |
| Synonyms | 2-iodanyl-4-methyl-benzoic acid |
| Wiley ID | 1430121 |