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4'-Methyl-3'-nitroacetophenone
SpectraBase Compound ID JZQwaUmuLLL
InChI InChI=1S/C9H9NO3/c1-6-3-4-8(7(2)11)5-9(6)10(12)13/h3-5H,1-2H3
InChIKey YRBBMDOBWRUMEZ-UHFFFAOYSA-N
Mol Weight 179.17 g/mol
Molecular Formula C9H9NO3
Exact Mass 179.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FMwENN66aY
Name 1-(4-Methyl-3-nitrophenyl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO3
InChI InChI=1S/C9H9NO3/c1-6-3-4-8(7(2)11)5-9(6)10(12)13/h3-5H,1-2H3
InChIKey YRBBMDOBWRUMEZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201000111
Molecular Weight 179.175 g/mol
SMILES CC(c1ccc(c(c1)[N+](=O)[O-])C)=O
SPLASH splash10-03di-3900000000-fb48676f2c0890251979
Source of Spectrum H-93-1270-17
Synonyms 1-(4-Methyl-3-nitrophenyl)ethan-1-one
Wiley ID 1784024