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4-Methyl-4-nitro-3-phenyl-pentanoic acid, methyl ester

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4-Methyl-4-nitro-3-phenyl-pentanoic acid, methyl ester
SpectraBase Compound ID 4RedAeF3isl
InChI InChI=1S/C13H17NO4/c1-13(2,14(16)17)11(9-12(15)18-3)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3
InChIKey GYUGHCRHUMATQB-UHFFFAOYSA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 75z0cz7ACBW
Name 4-Methyl-4-nitro-3-phenyl-pentanoic acid, methyl ester
CAS Registry Number 75919-28-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-13(2,14(16)17)11(9-12(15)18-3)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3
InChIKey GYUGHCRHUMATQB-UHFFFAOYSA-N
Literature Reference K. Matsumoto, Angew. Chem. 92, 1046 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3