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4,4,5-Trimethyl-1,3-dioxane

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4,4,5-Trimethyl-1,3-dioxane
SpectraBase Compound ID Gnb2iDZ3M9i
InChI InChI=1S/C7H14O2/c1-6-4-8-5-9-7(6,2)3/h6H,4-5H2,1-3H3
InChIKey ULMSSYJQRGAMHY-UHFFFAOYSA-N
Mol Weight 130.19 g/mol
Molecular Formula C7H14O2
Exact Mass 130.09938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4kKBOKRofuK
Name 4,4,5-Trimethyl-1,3-dioxane
CAS Registry Number 1122-03-8
Comments C5 EQ., 88 % C7 EQ.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H14O2
InChI InChI=1S/C7H14O2/c1-6-4-8-5-9-7(6,2)3/h6H,4-5H2,1-3H3
InChIKey ULMSSYJQRGAMHY-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference K. Pihlaja, T. Nurmi, Israel J. Chem. 20, 160 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3