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3,3-DIMETHYLBICYCLO[2.2.1]HEPTAN-2-ONE
SpectraBase Compound ID 7rIySLvh9E1
InChI InChI=1S/C9H14O/c1-9(2)7-4-3-6(5-7)8(9)10/h6-7H,3-5H2,1-2H3/t6-,7+/m1/s1
InChIKey ZYPYEBYNXWUCEA-RQJHMYQMSA-N
Mol Weight 138.21 g/mol
Molecular Formula C9H14O
Exact Mass 138.104465 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FrVXSQNepws
Name 3,3-DIMETHYL-BICYCLO-[2.2.1]-HEPTAN-2-ONE
CAS Registry Number 13211-15-9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14O
InChI InChI=1S/C9H14O/c1-9(2)7-4-3-6(5-7)8(9)10/h6-7H,3-5H2,1-2H3/t6-,7+/m1/s1
InChIKey ZYPYEBYNXWUCEA-RQJHMYQMSA-N
Literature Reference Author J.K.CRANDALL,M.A.CENTENO,S.BORRESEN
Literature Reference Citation J.ORG.CHEM.,44,1184(1979)
Literature Reference DOI 10.1021/jo01321a043
Solvent DIOXANE
Source File Reference UNIO736