| SpectraBase Spectrum ID |
kBC382HD6 |
| Name |
Methyl 2-methyl-2-bromomethyl-3-(hexylthio)-3-oxopropanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H21BrO3S |
| InChI |
InChI=1S/C12H21BrO3S/c1-4-5-6-7-8-17-11(15)12(2,9-13)10(14)16-3/h4-9H2,1-3H3 |
| InChIKey |
TZFMGYAILALASN-UHFFFAOYSA-N |
| Molecular Weight |
325.261 g/mol |
| SMILES |
C(C(=O)SCCCCCC)(C(=O)OC)(CBr)C |
| SPLASH |
splash10-0pw9-4940000000-9ff0a554ee32aff7fcd2 |
| Source of Spectrum |
H-79-2110-5 |
| Synonyms |
Methyl 2-(bromomethyl)-3-(hexylsulfanyl)-2-methyl-3-oxopropanoate |
| Wiley ID |
1322830 |
