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VALIDONE
SpectraBase Compound ID GylafyrngAy
InChI InChI=1S/C7H12O5/c8-2-3-1-4(9)6(11)7(12)5(3)10/h3,5-8,10-12H,1-2H2/t3-,5-,6+,7+/m1/s1
InChIKey ACVTTWBZLGNMCH-UMWONPOSSA-N
Mol Weight 176.17 g/mol
Molecular Formula C7H12O5
Exact Mass 176.068473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ftfj8J080nh
Name VALIDONE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O5
InChI InChI=1S/C7H12O5/c8-2-3-1-4(9)6(11)7(12)5(3)10/h3,5-8,10-12H,1-2H2/t3-,5-,6+,7+/m1/s1
InChIKey ACVTTWBZLGNMCH-UMWONPOSSA-N
Literature Reference Author H.DONG,T.MAHMUD,I.TORNUS,S.LEE,H.G.FLOSS
Literature Reference Citation J.AM.CHEM.SOC.,123,2733(2001)
Literature Reference DOI 10.1021/ja003643n
Molecular Weight 176.169 g/mol
Solvent CD3OD
Source File Reference UWLU32668