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NRFMZKXHPJBQBW-QYNIQEEDSA-N
SpectraBase Compound ID 9o4Dr2R5YT9
InChI InChI=1S/C7H12O/c1-5-3-2-4-6-7(5)8-6/h5-7H,2-4H2,1H3/t5-,6-,7+/m1/s1
InChIKey NRFMZKXHPJBQBW-QYNIQEEDSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E2cQmMmeGWh
Name NRFMZKXHPJBQBW-QYNIQEEDSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-5-3-2-4-6-7(5)8-6/h5-7H,2-4H2,1H3/t5-,6-,7+/m1/s1
InChIKey NRFMZKXHPJBQBW-QYNIQEEDSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 112.172 g/mol
Source File Reference MHKO2762