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VALIDATOL

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VALIDATOL
SpectraBase Compound ID LOULJcTHqD7
InChI InChI=1S/C7H14O4/c8-3-4-1-2-5(9)7(11)6(4)10/h4-11H,1-3H2/t4-,5-,6+,7+/m0/s1
InChIKey HSWSNXXNDSZDNQ-VWDOSNQTSA-N
Mol Weight 162.18 g/mol
Molecular Formula C7H14O4
Exact Mass 162.089209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EoJ0g36kemp
Name VALIDATOL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H14O4
InChI InChI=1S/C7H14O4/c8-3-4-1-2-5(9)7(11)6(4)10/h4-11H,1-3H2/t4-,5-,6+,7+/m0/s1
InChIKey HSWSNXXNDSZDNQ-VWDOSNQTSA-N
Literature Reference Author K.KROHN,G.BOERNER,S.GRINGARD
Literature Reference Citation J.ORG.CHEM.,59,6069(1994)
Literature Reference DOI 10.1021/jo00099a044
Molecular Weight 162.186 g/mol
Solvent D2O
Source File Reference UWCP7453