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1,1,1,5,5-PENTADEUTERIO-7-OCTENE-2,4-DIONE
SpectraBase Compound ID 1qHas8DBXHw
InChI InChI=1S/C8H12O2/c1-3-4-5-8(10)6-7(2)9/h3H,1,4-6H2,2H3/i2D3,5D2
InChIKey WVJUDQOQXFMLOH-ZTIZGVCASA-N
Mol Weight 145.21 g/mol
Molecular Formula C8H72H5O2
Exact Mass 145.115113 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4YJRSspEDFe
Name 1,1,1,5,5-PENTADEUTERIO-7-OCTENE-2,4-DIONE
Compound Number 1-1,1,1,5,5-D5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H72H5O2
InChI InChI=1S/C8H12O2/c1-3-4-5-8(10)6-7(2)9/h3H,1,4-6H2,2H3/i2D3,5D2
InChIKey WVJUDQOQXFMLOH-ZTIZGVCASA-N
Literature Reference Author H.QIAN,R.A.WIDENHOEFER
Literature Reference Citation J.AM.CHEM.SOC.,125,2056(2003)
Literature Reference DOI 10.1021/ja0293002
Molecular Weight 145.213 g/mol
Sample ID 40605
Solvent CDCl3