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acetic acid [4-(4-bromo-2-methyl-pyrazol-3-yl)-2-keto-butyl] ester

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acetic acid [4-(4-bromo-2-methyl-pyrazol-3-yl)-2-keto-butyl] ester
SpectraBase Compound ID 7wPnSaJtJ50
InChI InChI=1S/C10H13BrN2O3/c1-7(14)16-6-8(15)3-4-10-9(11)5-12-13(10)2/h5H,3-4,6H2,1-2H3
InChIKey WSTIZKJDRJYHBD-UHFFFAOYSA-N
Mol Weight 289.13 g/mol
Molecular Formula C10H13BrN2O3
Exact Mass 288.010955 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2s1rf9LzG7n
Name acetic acid [4-(4-bromo-2-methyl-pyrazol-3-yl)-2-keto-butyl] ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H13BrN2O3
InChI InChI=1S/C10H13BrN2O3/c1-7(14)16-6-8(15)3-4-10-9(11)5-12-13(10)2/h5H,3-4,6H2,1-2H3
InChIKey WSTIZKJDRJYHBD-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 289.129 g/mol
Source File Reference MHKO9936