John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=Lf80KZ6ai9o SpectraBase Spectrum ID=1JemWRslV4l

(accessed ).
(RAC)-6,7,8-TRIHYDROXY-2-OXABICYCLO-[3.3.0]-OCTAN-3-ONE
SpectraBase Compound ID Lf80KZ6ai9o
InChI InChI=1S/C7H10O5/c8-3-1-2-4(9)5(10)6(11)7(2)12-3/h2,4-7,9-11H,1H2/t2-,4+,5-,6-,7-/m1/s1
InChIKey QZBPBBDRAMFHFT-JPRCOVQVSA-N
Mol Weight 174.15 g/mol
Molecular Formula C7H10O5
Exact Mass 174.052824 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1JemWRslV4l
Name (RAC)-6,7,8-TRIHYDROXY-2-OXABICYCLO-[3.3.0]-OCTAN-3-ONE
Compound Number 12
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H10O5
InChI InChI=1S/C7H10O5/c8-3-1-2-4(9)5(10)6(11)7(2)12-3/h2,4-7,9-11H,1H2/t2-,4+,5-,6-,7-/m1/s1
InChIKey QZBPBBDRAMFHFT-JPRCOVQVSA-N
Literature Reference Author S.K.JOHANSEN,I.LUNDT
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3615(1999)
Literature Reference DOI 10.1039/a907008g
Molecular Weight 174.153 g/mol
Solvent D2O
Source File Reference UWKP2507
SpectraBase Batch ID 13WVOMqCOle