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1-methyl-4-prop-1-ynyl-3,5,8-trioxabicyclo[2.2.2]octane

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1-methyl-4-prop-1-ynyl-3,5,8-trioxabicyclo[2.2.2]octane
SpectraBase Compound ID gCvFotfnqM
InChI InChI=1S/C9H12O3/c1-3-4-9-10-5-8(2,6-11-9)7-12-9/h5-7H2,1-2H3
InChIKey JGKUDOHRIZMPDU-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C9H12O3
Exact Mass 168.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FpnmZHLiVOB
Name 1-methyl-4-prop-1-ynyl-3,5,8-trioxabicyclo[2.2.2]octane
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-3-4-9-10-5-8(2,6-11-9)7-12-9/h5-7H2,1-2H3
InChIKey JGKUDOHRIZMPDU-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2010)
Molecular Weight 168.192 g/mol
Source File Reference MHKO26069