SpectraBase Compound ID | 3iff50YiMEy |
---|---|
InChI | InChI=1S/C8H15BrO2/c1-7(5-6-9)3-4-8(10)11-2/h7H,3-6H2,1-2H3/t7-/m0/s1 |
InChIKey | INPIXQOEAFBKGN-ZETCQYMHSA-N |
Mol Weight | 223.11 g/mol |
Molecular Formula | C8H15BrO2 |
Exact Mass | 222.025543 g/mol |
SpectraBase Spectrum ID | 3qClkvraPqP |
---|---|
Name | Methyl (4S)-6-Bromo-4-methylhexanoate |
Comments | Less than 3 mono-isotopic peaks |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H15BrO2 |
InChI | InChI=1S/C8H15BrO2/c1-7(5-6-9)3-4-8(10)11-2/h7H,3-6H2,1-2H3/t7-/m0/s1 |
InChIKey | INPIXQOEAFBKGN-ZETCQYMHSA-N |
Molecular Weight | 223.110 g/mol |
SMILES | C(=O)(CC[C@@](CCBr)(C)[H])OC |
SPLASH | splash10-00i0-0090000000-04cb958eddc4c93ae778 |
Source of Spectrum | U1-2011-5899-3 |
Wiley ID | 1688658 |