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3,3,3-Trifluoro-1-(4-nitrophenyl)propan-1-one
SpectraBase Compound ID Bf81P4nS0Py
InChI InChI=1S/C9H6F3NO3/c10-9(11,12)5-8(14)6-1-3-7(4-2-6)13(15)16/h1-4H,5H2
InChIKey IVKPNYAMBOJGKI-UHFFFAOYSA-N
Mol Weight 233.15 g/mol
Molecular Formula C9H6F3NO3
Exact Mass 233.029978 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ltd5Eqap7cq
Name 3,3,3-Trifluoro-1-(4-nitrophenyl)propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6F3NO3
InChI InChI=1S/C9H6F3NO3/c10-9(11,12)5-8(14)6-1-3-7(4-2-6)13(15)16/h1-4H,5H2
InChIKey IVKPNYAMBOJGKI-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol3034059
Molecular Weight 233.146 g/mol
SMILES c1cc(ccc1[N+](=O)[O-])C(CC(F)(F)F)=O
SPLASH splash10-0udi-1900000000-2586fba0ad62f837dfd7
Source of Spectrum A1-15-406/SM8-2s
Synonyms 3,3,3-trifluoro-1-(4-nitrophenyl)-1-propanone 3,3,3-tris(fluoranyl)-1-(4-nitrophenyl)propan-1-one
Wiley ID 1750983