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3-Methyl-2-isoxazolin-5-one, compound with morpholine(1:1)
SpectraBase Compound ID 1x3IveRJ3n5
InChI InChI=1S/2C4H5NO2.2C4H9NO/c2*1-3-2-4(6)7-5-3;2*1-3-6-4-2-5-1/h2H2,1H3;2,6H,1H3;2*5H,1-4H2/i2D;;;
InChIKey PEUSXHQLVSWONN-OZPRGXNDSA-N
Mol Weight 373.43 g/mol
Molecular Formula C16H272HN4O6
Exact Mass 373.207161 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EFga6cVGPl2
Name 3-METHYL-2-ISOXAZOLIN-5-ONE, COMPOUND WITH MORPHOLINE (1:1)
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 67823-26-1
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5NO2 C4H9NO
InChI InChI=1S/2C4H5NO2.2C4H9NO/c2*1-3-2-4(6)7-5-3;2*1-3-6-4-2-5-1/h2H2,1H3;2,6H,1H3;2*5H,1-4H2/i2D;;;
InChIKey PEUSXHQLVSWONN-OZPRGXNDSA-N
Molecular Weight 186.21
Solvent Deuterium oxide; Reference=Dioxane Spectrometer= Varian CFT-20