| SpectraBase Compound ID | AYBZKq7IGaG |
|---|---|
| InChI | InChI=1S/C8H13IO2/c1-11-8(10)6-4-2-3-5-7-9/h5,7H,2-4,6H2,1H3/b7-5+ |
| InChIKey | CMVGBPGOVOGVGM-FNORWQNLSA-N |
| Mol Weight | 268.09 g/mol |
| Molecular Formula | C8H13IO2 |
| Exact Mass | 267.996025 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6iA4qToNp5c |
|---|---|
| Name | Methyl (E)-7-iodo-6-heptenoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H13IO2 |
| InChI | InChI=1S/C8H13IO2/c1-11-8(10)6-4-2-3-5-7-9/h5,7H,2-4,6H2,1H3/b7-5+ |
| InChIKey | CMVGBPGOVOGVGM-FNORWQNLSA-N |
| Molecular Weight | 268.094 g/mol |
| SMILES | C(CCCC\C=C\I)(=O)OC |
| SPLASH | splash10-0006-0910000000-ae453ca899e49feae26e |
| Source of Spectrum | F-51-3723-4 |
| Synonyms | Methyl (6E)-7-iodo-6-heptenoate |
| Wiley ID | 791667 |