John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=12I6lWb1Pxh SpectraBase Spectrum ID=9VGUtdfI86A

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(1-ALPHA,3-ALPHA,5-ALPHA,8-ALPHA)-4,9-DIOXATRICYCLO-[6.1.0.0(3,5)]-NON-6-EN-2-ONE
SpectraBase Compound ID 12I6lWb1Pxh
InChI InChI=1S/C7H6O3/c8-5-6-3(9-6)1-2-4-7(5)10-4/h1-4,6-7H/t3-,4+,6-,7+
InChIKey CYVNMVLCGYMANP-GMWLOFBXSA-N
Mol Weight 138.12 g/mol
Molecular Formula C7H6O3
Exact Mass 138.031694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9VGUtdfI86A
Name (1-ALPHA,3-ALPHA,5-ALPHA,8-ALPHA)-4,9-DIOXATRICYCLO-[6.1.0.0(3,5)]-NON-6-EN-2-ONE
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H6O3
InChI InChI=1S/C7H6O3/c8-5-6-3(9-6)1-2-4-7(5)10-4/h1-4,6-7H/t3-,4+,6-,7+
InChIKey CYVNMVLCGYMANP-GMWLOFBXSA-N
Literature Reference Author W.SEPPELT,C.RUECKER,C.KAISER,H.PRINZBACH
Literature Reference Citation CHEM.BER.,117,1834(1984)
Literature Reference DOI 10.1002/cber.19841170512
Molecular Weight 138.123 g/mol
Solvent CDCl3:DMSO-D6
Source File Reference UWGB1575
SpectraBase Batch ID 4sNIs8Hwymw