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3-(2-Mercaptoimidazol-4-yl)propanoic acid

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3-(2-Mercaptoimidazol-4-yl)propanoic acid
SpectraBase Compound ID KR4kcvcAZ8f
InChI InChI=1S/C6H8N2O2S/c9-5(10)2-1-4-3-7-6(11)8-4/h3H,1-2H2,(H,9,10)(H2,7,8,11)
InChIKey GJJYHCODZSYWKO-UHFFFAOYSA-N
Mol Weight 172.2 g/mol
Molecular Formula C6H8N2O2S
Exact Mass 172.030649 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5cgcylYuBFm
Name 3-(2-MERCAPTOIMIDAZOL-4-YL)-PROPANOIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H8N2O2S
InChI InChI=1S/C6H8N2O2S/c9-5(10)2-1-4-3-7-6(11)8-4/h3H,1-2H2,(H,9,10)(H2,7,8,11)
InChIKey GJJYHCODZSYWKO-UHFFFAOYSA-N
Literature Reference Author R.M.LUEOEND,J.WALKER,R.W.NEIER
Literature Reference Citation J.ORG.CHEM.,57,5005(1992)
Literature Reference DOI 10.1021/jo00044a041
Molecular Weight 172.202 g/mol
Solvent DMSO-D6
Source File Reference UWCS1288