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2-Bromomethyl-4-thiophen-carboxylic-acid
SpectraBase Compound ID JugLpuyByIw
InChI InChI=1S/C6H5BrO2S/c7-2-5-1-4(3-10-5)6(8)9/h1,3H,2H2,(H,8,9)
InChIKey QYDQFYYJFTYLKP-UHFFFAOYSA-N
Mol Weight 221.07 g/mol
Molecular Formula C6H5BrO2S
Exact Mass 219.919364 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HkJ2ntxtvGn
Name 2-BROMOMETHYL-4-THIOPHEN-CARBOXYLIC-ACID
CAS Registry Number 61854-97-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H5BrO2S
InChI InChI=1S/C6H5BrO2S/c7-2-5-1-4(3-10-5)6(8)9/h1,3H,2H2,(H,8,9)
InChIKey QYDQFYYJFTYLKP-UHFFFAOYSA-N
Literature Reference Author A.PERJESSY,M.JANDA,D.W.BOYKIN
Literature Reference Citation J.ORG.CHEM.,45,1366(1980)
Literature Reference DOI 10.1021/jo01296a004
Molecular Weight 221.069 g/mol
Solvent DMSO-D6
Source File Reference UNIW18707