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Acetophenone
SpectraBase Compound ID 2vwDA8qiyNR
InChI InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey KWOLFJPFCHCOCG-UHFFFAOYSA-N
Mol Weight 120.15 g/mol
Molecular Formula C8H8O
Exact Mass 120.057515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 17Kd5QMUhZx
Name 1-phenylethanone
Carrier Gas (1 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 120.057514877 u
Formula C8H8O
GC Column DB-5 (30 m x 250 micrometer, film thickness 0.25 micrometer)
GC Oven Program Oven temp 280oC
InChI InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey KWOLFJPFCHCOCG-UHFFFAOYSA-N
Instrument Name Agilent 6890-5973 MSD
Ionization Type EI
Literature Reference DOI 10.1002/anie.202307042
Molecular Weight 120.151 g/mol
Quality 750
SMILES C1=CC(=CC=C1)C(=O)C
SPLASH splash10-0a6r-9700000000-35c28551695e1a18975f
Source of Spectrum ACI-62-SM15-Figure S12-1 (DOI: 10.1002/anie.202307042)
Wiley ID 1911908