SpectraBase Spectrum ID |
DXhCO2Gxiqt |
Name |
(3R)-3-(bromomethyl)hexanoic acid |
Appearance |
Pale yellow oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C7H13BrO2 |
InChI |
InChI=1S/C7H13BrO2/c1-2-3-6(5-8)4-7(9)10/h6H,2-5H2,1H3,(H,9,10)/t6-/m1/s1 |
InChIKey |
XUBVYXDJGCTGTL-ZCFIWIBFSA-N |
Instrument Name |
GCMS |
Ionization Type |
EI |
Molecular Weight |
209.083 g/mol |
SMILES |
OC(C[C@](CBr)(CCC)[H])=O |
SPLASH |
splash10-00di-9300000000-f2e4e18e4d3b6d0a2eb3 |
Source of Spectrum |
WO2020148787A1 |
Wiley ID |
1879817 |