| SpectraBase Compound ID | IWC509NcgkP |
|---|---|
| InChI | InChI=1S/C6H8ClNOS/c7-2-1-6-5(4-9)3-8-10-6/h3,9H,1-2,4H2 |
| InChIKey | XGDPVTNQSNHRCB-UHFFFAOYSA-N |
| Mol Weight | 177.65 g/mol |
| Molecular Formula | C6H8ClNOS |
| Exact Mass | 177.001513 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CbEoofu68Ui |
|---|---|
| Name | 4-Hydroxymethyl-5-(2-chloroethyl)-1,3-isothiazole |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H8ClNOS |
| InChI | InChI=1S/C6H8ClNOS/c7-2-1-6-5(4-9)3-8-10-6/h3,9H,1-2,4H2 |
| InChIKey | XGDPVTNQSNHRCB-UHFFFAOYSA-N |
| Molecular Weight | 177.649 g/mol |
| SMILES | OCc1c(snc1)CCCl |
| SPLASH | splash10-0fk9-0900000000-a33e78aa550ea04a96c1 |
| Source of Spectrum | CJ-1992-0-0 |
| Synonyms | [5-(2-chloroethyl)-4-isothiazolyl]methanol |
| Wiley ID | 1172961 |