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(1RS,5SR,6RS,7RS)-6,7-BIS-(HYDROXYMETHYL)-3-OXABICYCLO-[3.2.0]-HEPTAN-2-ONE
SpectraBase Compound ID 3NpweLEX4U8
InChI InChI=1S/C8H12O4/c9-1-4-5(2-10)7-6(4)3-12-8(7)11/h4-7,9-10H,1-3H2/t4-,5-,6+,7-/m1/s1
InChIKey LJTQMNKYTBPTNM-MVIOUDGNSA-N
Mol Weight 172.18 g/mol
Molecular Formula C8H12O4
Exact Mass 172.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DcICDdHsPup
Name (1RS,5SR,6RS,7RS)-6,7-BIS-(HYDROXYMETHYL)-3-OXABICYCLO-[3.2.0]-HEPTAN-2-ONE
Compound Number 14C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12O4
InChI InChI=1S/C8H12O4/c9-1-4-5(2-10)7-6(4)3-12-8(7)11/h4-7,9-10H,1-3H2/t4-,5-,6+,7-/m1/s1
InChIKey LJTQMNKYTBPTNM-MVIOUDGNSA-N
Literature Reference Author S.PARES,P.D.MARCH,J.FONT,R.ALIBES,M.FIGUEREDO
Literature Reference Citation EUR.J.ORG.CHEM.,2011,3888(2011)
Literature Reference DOI 10.1002/ejoc.201100067
Molecular Weight 172.181 g/mol
Solvent ACETONE-D6
Source File Reference UWBT20886