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3-(4-Nitrobenzylidene)pentane-2,4-dione

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3-(4-Nitrobenzylidene)pentane-2,4-dione
SpectraBase Compound ID EZGdYNlPlz4
InChI InChI=1S/C12H11NO4/c1-8(14)12(9(2)15)7-10-3-5-11(6-4-10)13(16)17/h3-7H,1-2H3
InChIKey YZFGYWARVCXNKL-UHFFFAOYSA-N
Mol Weight 233.22 g/mol
Molecular Formula C12H11NO4
Exact Mass 233.068808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ZCxPhfSF3d
Name 3-(4-Nitro-benzylidene)-2,4-pentanedione
CAS Registry Number 29197-16-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H11NO4
InChI InChI=1S/C12H11NO4/c1-8(14)12(9(2)15)7-10-3-5-11(6-4-10)13(16)17/h3-7H,1-2H3
InChIKey YZFGYWARVCXNKL-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference E. Solcaniova, P. Hrnciar, T. Liptaj, Org. Magn. Resonance 18, 55 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3