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5-NITRO-2,2,5-TRIMETHYL-m-DIOXANE

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5-NITRO-2,2,5-TRIMETHYL-m-DIOXANE
SpectraBase Compound ID 3HRVLkUWOGx
InChI InChI=1S/C7H13NO4/c1-6(2)11-4-7(3,5-12-6)8(9)10/h4-5H2,1-3H3
InChIKey NDRKIYYXYJRZQA-UHFFFAOYSA-N
Mol Weight 175.18 g/mol
Molecular Formula C7H13NO4
Exact Mass 175.084458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FRUgGNnBlcm
Name 5-NITRO-2,2,5-TRIMETHYL-m-DIOXANE
Source of Sample E. G. Janzen, R. L. Dudley, R. V. Shetty J. Amer. Chem. Soc. 101, 243(1979)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13NO4
InChI InChI=1S/C7H13NO4/c1-6(2)11-4-7(3,5-12-6)8(9)10/h4-5H2,1-3H3
InChIKey NDRKIYYXYJRZQA-UHFFFAOYSA-N
Molecular Weight 175.19
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Not Reported
Synonyms M-DIOXANE, 5-NITRO-2,2,5-TRIMETHYL-,