| SpectraBase Compound ID | 1e4RHnwOR85 |
|---|---|
| InChI | InChI=1S/C6H7IO2/c1-9-6(8)4-2-3-5-7/h2,4H2,1H3 |
| InChIKey | SCXAHKPOMWMTNG-UHFFFAOYSA-N |
| Mol Weight | 238.02 g/mol |
| Molecular Formula | C6H7IO2 |
| Exact Mass | 237.949074 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IjYGC1Qsv64 |
|---|---|
| Name | Methyl 5-Iodo-4-pentynoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H7IO2 |
| InChI | InChI=1S/C6H7IO2/c1-9-6(8)4-2-3-5-7/h2,4H2,1H3 |
| InChIKey | SCXAHKPOMWMTNG-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1002/cmdc.201200366 |
| Molecular Weight | 238.024 g/mol |
| SMILES | C(CCC#CI)(=O)OC |
| SPLASH | splash10-03fr-1690000000-d43937687427d54f877e |
| Source of Spectrum | CMC-7-2101/SM32-SI_25 |
| Synonyms | Methyl 5-iodopent-4-ynoate |
| Wiley ID | 1771793 |