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4-(benzyl)-5-isopropyl-3H-imidazole-2-sulfinic acid
SpectraBase Compound ID 33DV7pBtkNr
InChI InChI=1S/C13H16N2O2S/c1-9(2)12-11(14-13(15-12)18(16)17)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,14,15)(H,16,17)
InChIKey JTFVPEBZUFQHMH-UHFFFAOYSA-N
Mol Weight 264.34 g/mol
Molecular Formula C13H16N2O2S
Exact Mass 264.093249 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GFVWwitexYf
Name 4-(benzyl)-5-isopropyl-3H-imidazole-2-sulfinic acid
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16N2O2S
InChI InChI=1S/C13H16N2O2S/c1-9(2)12-11(14-13(15-12)18(16)17)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,14,15)(H,16,17)
InChIKey JTFVPEBZUFQHMH-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 264.342 g/mol
Source File Reference MHKO26681