| SpectraBase Compound ID | EKSo4w7w5jR |
|---|---|
| InChI | InChI=1S/C7H9IO3/c1-5(8)6(9)3-4-7(10)11-2/h3-5H,1-2H3/b4-3+ |
| InChIKey | QEYRHCRZOBTKIR-ONEGZZNKSA-N |
| Mol Weight | 268.05 g/mol |
| Molecular Formula | C7H9IO3 |
| Exact Mass | 267.959639 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Lsbgyh9czWw |
|---|---|
| Name | 5-IODO-4-OXOHEX-2-ENOIC ACID, METHYL ESTER |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H9O3I |
| InChI | InChI=1S/C7H9IO3/c1-5(8)6(9)3-4-7(10)11-2/h3-5H,1-2H3/b4-3+ |
| InChIKey | QEYRHCRZOBTKIR-ONEGZZNKSA-N |
| Molecular Weight | 267.9553 |
| SMILES | COC(=O)\C=C\C(C(I)C)=O |
| SPLASH | splash10-03dl-7900000000-45df9aef4730b745b132 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |