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syn-5-Methyl-6-nitro-6-phenylhexan-2,3-dione
SpectraBase Compound ID EKZMr8piBpu
InChI InChI=1S/C13H15NO4/c1-9(8-12(16)10(2)15)13(14(17)18)11-6-4-3-5-7-11/h3-7,9,13H,8H2,1-2H3
InChIKey RPAHZTHMTJDDFO-UHFFFAOYSA-N
Mol Weight 249.27 g/mol
Molecular Formula C13H15NO4
Exact Mass 249.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NAfCYMh4o5
Name syn-5-Methyl-6-nitro-6-phenylhexan-2,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO4
InChI InChI=1S/C13H15NO4/c1-9(8-12(16)10(2)15)13(14(17)18)11-6-4-3-5-7-11/h3-7,9,13H,8H2,1-2H3
InChIKey RPAHZTHMTJDDFO-UHFFFAOYSA-N
Molecular Weight 249.266 g/mol
SMILES C(N(=O)=O)(C(CC(C(=O)C)=O)C)c1ccccc1
SPLASH splash10-0006-9500000000-68d9af930e0f07878410
Source of Spectrum SO-0-246-6
Synonyms anti-5-Methyl-6-nitro-6-phenylhexan-2,3-dione 5-Methyl-6-nitro-6-phenyl-2,3-hexanedione 5-Methyl-6-nitro-6-phenylhexane-2,3-dione
Wiley ID 873392