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(1-ALPHA,2-ALPHA,4-ALPHA,5-ALPHA,6-ALPHA,8-ALPHA)-3,7,9-TRIOXATETRACYCLO-[3.3.1.0(2,4).0(6,8)]-NONANE
SpectraBase Compound ID I2qfPHoYN03
InChI InChI=1S/C6H6O3/c7-1-2(7)6-4-3(8-4)5(1)9-6/h1-6H/t1-,2+,3+,4-,5-,6+
InChIKey VGAWCYFAZJFAKA-SPNMXKBISA-N
Mol Weight 126.11 g/mol
Molecular Formula C6H6O3
Exact Mass 126.031694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IVcDVqBAknU
Name (1-ALPHA,2-ALPHA,4-ALPHA,5-ALPHA,6-ALPHA,8-ALPHA)-3,7,9-TRIOXATETRACYCLO-[3.3.1.0(2,4).0(6,8)]-NONANE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H6O3
InChI InChI=1S/C6H6O3/c7-1-2(7)6-4-3(8-4)5(1)9-6/h1-6H/t1-,2+,3+,4-,5-,6+
InChIKey VGAWCYFAZJFAKA-SPNMXKBISA-N
Literature Reference Author H.PRINZBACH,H.BINGMANN,J.MARKERT,G.FISCHER,L.KNOTHE,W.EBERBA CH,J.BROKATZKY-GEIGE
Literature Reference Citation CHEM.BER.,119,589(1986)
Literature Reference DOI 10.1002/cber.19861190222
Molecular Weight 126.112 g/mol
Solvent CDCl3
Source File Reference UWGB1669