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3,3-Dimethyl-1-phenylbutane-1,2-dione
SpectraBase Compound ID I4EBhFYurrN
InChI InChI=1S/C12H14O2/c1-12(2,3)11(14)10(13)9-7-5-4-6-8-9/h4-8H,1-3H3
InChIKey OSNJBWPTGQHCQC-UHFFFAOYSA-N
Mol Weight 190.24 g/mol
Molecular Formula C12H14O2
Exact Mass 190.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JUNFYOzadwl
Name 3,3-Dimethyl-1-phenylbutane-1,2-dione
Appearance Green oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O2
InChI InChI=1S/C12H14O2/c1-12(2,3)11(14)10(13)9-7-5-4-6-8-9/h4-8H,1-3H3
InChIKey OSNJBWPTGQHCQC-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/cjoc.202000040
Molecular Weight 190.242 g/mol
SMILES C(C(C(C)(C)C)=O)(=O)c1ccccc1
SPLASH splash10-0a4i-7900000000-75adb4e40a69323b1dd4
Source of Spectrum CJC-38-556-2j
Wiley ID 1839927