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3,5-DIMETHYL-1-(3-METHYL-4-NITROBUTANOYL)-PYRAZOLE

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3,5-DIMETHYL-1-(3-METHYL-4-NITROBUTANOYL)-PYRAZOLE
SpectraBase Compound ID 7RfFjzsoKRI
InChI InChI=1S/C10H15N3O3/c1-7(6-12(15)16)4-10(14)13-9(3)5-8(2)11-13/h5,7H,4,6H2,1-3H3
InChIKey SEUKZKFULRXVFA-UHFFFAOYSA-N
Mol Weight 225.25 g/mol
Molecular Formula C10H15N3O3
Exact Mass 225.111341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3P86YavF81Y
Name 3,5-DIMETHYL-1-(3-METHYL-4-NITROBUTANOYL)-PYRAZOLE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H15N3O3
InChI InChI=1S/C10H15N3O3/c1-7(6-12(15)16)4-10(14)13-9(3)5-8(2)11-13/h5,7H,4,6H2,1-3H3
InChIKey SEUKZKFULRXVFA-UHFFFAOYSA-N
Literature Reference Author K.ITOH,S.KANEMASA
Literature Reference Citation J.AM.CHEM.SOC.,124,13394(2002)
Literature Reference DOI 10.1021/ja027313+
Molecular Weight 225.247 g/mol
Sample ID 48350
Solvent CDCl3