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4-Acetylphenyl Methyl Sulfoxide
SpectraBase Compound ID Dizu7haavto
InChI InChI=1S/C9H10O2S/c1-7(10)8-3-5-9(6-4-8)12(2)11/h3-6H,1-2H3
InChIKey NTUFNCGULZBNCK-UHFFFAOYSA-N
Mol Weight 182.24 g/mol
Molecular Formula C9H10O2S
Exact Mass 182.040151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID TAdOzQbRP8
Name 1-(4-methylsulfinylphenyl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O2S
GC Column DB-5 MS fused silica (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 220oC
InChI InChI=1S/C9H10O2S/c1-7(10)8-3-5-9(6-4-8)12(2)11/h3-6H,1-2H3
InChIKey NTUFNCGULZBNCK-UHFFFAOYSA-N
Instrument Name Shimadzu GC-17A-QP5050A or Shimadzu GC-2010-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/chem.202102757
Molecular Weight 182.237 g/mol
Quality 993
SMILES C1(S(C)=O)=CC=C(C=C1)C(=O)C
SPLASH splash10-0f6x-9500000000-b8ee788a973c0b1c8a8b
Source of Spectrum QE-27-SM35-35-2 (DOI: 10.1002/chem.202102757)
Wiley ID 1904153