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4,4-Dimethyl-5-nitro-hexan-2-one
SpectraBase Compound ID LVDynPuLI5D
InChI InChI=1S/C8H15NO3/c1-6(10)5-8(3,4)7(2)9(11)12/h7H,5H2,1-4H3
InChIKey FOUPXYMBEKVMTH-UHFFFAOYSA-N
Mol Weight 173.21 g/mol
Molecular Formula C8H15NO3
Exact Mass 173.105193 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3e8s88D9cfx
Name 4,4-Dimethyl-5-nitro-hexan-2-one
CAS Registry Number 35417-25-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H15NO3
InChI InChI=1S/C8H15NO3/c1-6(10)5-8(3,4)7(2)9(11)12/h7H,5H2,1-4H3
InChIKey FOUPXYMBEKVMTH-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference K-H. Lui, M.P. Sammes, J. Chem. Soc. Perkin I 457 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3