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2-Methyl-4-nitro-hexanoic acid, methyl ester

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2-Methyl-4-nitro-hexanoic acid, methyl ester
SpectraBase Compound ID BP2Hval1mEV
InChI InChI=1S/C8H15NO4/c1-4-7(9(11)12)5-6(2)8(10)13-3/h6-7H,4-5H2,1-3H3
InChIKey XAWBZAOPKSSAPP-UHFFFAOYSA-N
Mol Weight 189.21 g/mol
Molecular Formula C8H15NO4
Exact Mass 189.100108 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Xy3JAH3r3o
Name 2-METHYL-4-NITROHEXANOIC ACID, METHYL ESTER
Source of Sample K. Matsumoto Angew. Chem. 92, 1046(1980)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H15NO4
InChI InChI=1S/C8H15NO4/c1-4-7(9(11)12)5-6(2)8(10)13-3/h6-7H,4-5H2,1-3H3
InChIKey XAWBZAOPKSSAPP-UHFFFAOYSA-N
Molecular Weight 189.21
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Not Reported
Synonyms HEXANOIC ACID, 2-METHYL-4-NITRO-, METHYL ESTER