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1-Phenyl-1,2-propanedione

View entire compound with spectra: 10 NMR, 9 FTIR, 2 Raman, 1 UV-Vis, and 19 MS (GC)

1-Phenyl-1,2-propanedione
SpectraBase Compound ID AWCWufbcLPm
InChI InChI=1S/C9H8O2/c1-7(10)9(11)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey BVQVLAIMHVDZEL-UHFFFAOYSA-N
Mol Weight 148.16 g/mol
Molecular Formula C9H8O2
Exact Mass 148.052429 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Hr6NCp4e9l
Name [1,2,3-(13)C(3)]-1-PHENYLPROPANE-1,2-DIONE
Compound Number [1,2,3-(13)C(3)]-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8O2
InChI InChI=1S/C9H8O2/c1-7(10)9(11)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey BVQVLAIMHVDZEL-UHFFFAOYSA-N
Literature Reference Author G.GRUE-SORENSEN,I.D.SPENSER
Literature Reference Citation J.AM.CHEM.SOC.,116,6195(1994)
Literature Reference DOI 10.1021/ja00093a019
Molecular Weight 148.161 g/mol
Solvent CDCl3
Source File Reference UWRU10876