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[(2,3-dimethyl-5-oxo-1-phenyl-3-pyrazolin-4-yl)methyl]trimethylammonium iodide

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[(2,3-dimethyl-5-oxo-1-phenyl-3-pyrazolin-4-yl)methyl]trimethylammonium iodide
SpectraBase Compound ID Ab6hqv9Z6p7
InChI InChI=1S/C15H22N3O.HI/c1-12-14(11-18(3,4)5)15(19)17(16(12)2)13-9-7-6-8-10-13;/h6-10H,11H2,1-5H3;1H/q+1;/p-1
InChIKey SINKTVIKJAKNNO-UHFFFAOYSA-M
Mol Weight 387.27 g/mol
Molecular Formula C15H22IN3O
Exact Mass 387.080757 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H6qvSmIHcFc
Name [(2,3-DIMETHYL-5-OXO-1-PHENYL-3-PYRAZOLIN-4-YL)METHYL]TRIMETHYL-AMMONIUM IODIDE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22IN3O
InChI InChI=1S/C15H22N3O.HI/c1-12-14(11-18(3,4)5)15(19)17(16(12)2)13-9-7-6-8-10-13;/h6-10H,11H2,1-5H3;1H/q+1;/p-1
InChIKey SINKTVIKJAKNNO-UHFFFAOYSA-M
Molecular Weight 387.27
Solvent Deuterium oxide; Reference=TSP Spectrometer= Bruker AC-300
Synonyms AMMONIUM IODIDE, //2,3-DIMETHYL- 5-OXO-1-PHENYL-3-PYRAZOLIN-4-YL/- METHYL/TRIMETHYL-,