SpectraBase Spectrum ID |
96qgWM8PDGv |
Name |
2-(5-Bromo-2-methylthiophen-3-yl)-acetic Acid |
Appearance |
Orange solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
233.935013637 u |
Formula |
C7H7BrO2S |
InChI |
InChI=1S/C7H7BrO2S/c1-4-5(3-7(9)10)2-6(8)11-4/h2H,3H2,1H3,(H,9,10) |
InChIKey |
XXQURUSYXUFAMP-UHFFFAOYSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/ejoc.201800101 |
Molecular Weight |
235.095 g/mol |
Quality |
62 |
Reported Formula |
(12)C7(1)H7(79)Br(16)O2(32)S |
SMILES |
OC(CC=1C=C(Br)SC1C)=O |
SPLASH |
splash10-000l-0940000000-6c81555c73ff853eb9a8 |
Source of Spectrum |
K1-2018-2599-13 (DOI: 10.1002/ejoc.201800101) |
Wiley ID |
1894033 |