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4-[[(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-METHYL]-AMINO]-BENZOIC-ACID

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4-[[(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-METHYL]-AMINO]-BENZOIC-ACID
SpectraBase Compound ID IbkFnHOd2C6
InChI InChI=1S/C13H15N3O2/c1-9-7-10(2)16(15-9)8-14-12-5-3-11(4-6-12)13(17)18/h3-7,14H,8H2,1-2H3,(H,17,18)
InChIKey CNKABRURYDJZAR-UHFFFAOYSA-N
Mol Weight 245.28 g/mol
Molecular Formula C13H15N3O2
Exact Mass 245.116427 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 42CqTyEo6HD
Name 4-[[(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-METHYL]-AMINO]-BENZOIC-ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H15N3O2
InChI InChI=1S/C13H15N3O2/c1-9-7-10(2)16(15-9)8-14-12-5-3-11(4-6-12)13(17)18/h3-7,14H,8H2,1-2H3,(H,17,18)
InChIKey CNKABRURYDJZAR-UHFFFAOYSA-N
Literature Reference Author M.E.KODADI,F.MALEK,A.RAMDANI
Literature Reference Citation MOLBANK,M368(2004)
Molecular Weight 245.281 g/mol
Solvent DMSO-D6
Source File Reference UWPA1433