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WOKKCJBCWDOUCU-UHFFFAOYSA-N
SpectraBase Compound ID 2pzAWiFLhtj
InChI InChI=1S/C7H6O2/c1-3-5-6-9-7(8)4-2/h2H,6H2,1H3
InChIKey WOKKCJBCWDOUCU-UHFFFAOYSA-N
Mol Weight 122.12 g/mol
Molecular Formula C7H6O2
Exact Mass 122.036779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID rPt7Mt7Jte
Name 2-BUTYN-1-YL-PROPIOLATE;(VITAMIN-D-DERIVATIVE)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H6O2
InChI InChI=1S/C7H6O2/c1-3-5-6-9-7(8)4-2/h2H,6H2,1H3
InChIKey WOKKCJBCWDOUCU-UHFFFAOYSA-N
Literature Reference Author S.A.BARRACK,R.A.GIBBS,W.H.OKAMURA
Literature Reference Citation J.ORG.CHEM.,53,1790(1988)
Literature Reference DOI 10.1021/jo00243a035
Molecular Weight 122.123 g/mol
Solvent CDCl3
Source File Reference UWWR5094