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Ethyl 2(2-pyridyl)-4-(bromomethyl)thiazole-5-carboxylate
SpectraBase Compound ID GIqU6aWRJyk
InChI InChI=1S/C12H11BrN2O2S/c1-2-17-12(16)10-9(7-13)15-11(18-10)8-5-3-4-6-14-8/h3-6H,2,7H2,1H3
InChIKey RNJKUHUGSBTCRJ-UHFFFAOYSA-N
Mol Weight 327.2 g/mol
Molecular Formula C12H11BrN2O2S
Exact Mass 325.972462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5kXPbQWdwM5
Name Ethyl 2(2-pyridyl)-4-(bromomethyl)thiazole-5-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 325.972461774 u
Formula C12H11BrN2O2S
InChI InChI=1S/C12H11BrN2O2S/c1-2-17-12(16)10-9(7-13)15-11(18-10)8-5-3-4-6-14-8/h3-6H,2,7H2,1H3
InChIKey RNJKUHUGSBTCRJ-UHFFFAOYSA-N
Molecular Weight 327.196 g/mol
SMILES CCOC(=O)C=1SC(C2=CC=CC=N2)=NC1CBr