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3-OXATRICYCLO[4.2.0.0(2,4)]OCTAN-7-ONE, ETHYLENE KETAL
SpectraBase Compound ID 5fp8MI3xjUP
InChI InChI=1S/C9H12O3/c1-2-11-9(10-1)4-5-6(9)3-7-8(5)12-7/h5-8H,1-4H2/t5-,6-,7+,8-/m1/s1
InChIKey IHFHTGNFDZHEGR-OOJXKGFFSA-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 KztQ1pvYRak
Name 3-OXATRICYCLO[4.2.0.0(2,4)]OCTAN-7-ONE, ETHYLENE KETAL
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H12O3
InChI InChI=1S/C9H12O3/c1-2-11-9(10-1)4-5-6(9)3-7-8(5)12-7/h5-8H,1-4H2/t5-,6-,7+,8-/m1/s1
InChIKey IHFHTGNFDZHEGR-OOJXKGFFSA-N
Instrument Name Bruker WH-90
Literature Reference O.PARVE, A.PALS, M.LYKHMUS, T.VALIMAE, M.LOPP, U.LILLE (1985) Izv.Akad.NaukEstonii,Khim.(Russ. Lang.): v.34, N4, 276-284.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported