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1-[2-(Methylthio)-5-nitrophenyl]ethan-1-one
SpectraBase Compound ID JJ5tMa57xKp
InChI InChI=1S/C9H9NO3S/c1-6(11)8-5-7(10(12)13)3-4-9(8)14-2/h3-5H,1-2H3
InChIKey JUSPIIZYFLLBBK-UHFFFAOYSA-N
Mol Weight 211.23 g/mol
Molecular Formula C9H9NO3S
Exact Mass 211.030314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A9k7N4leYsm
Name 1-[2-(Methylthio)-5-nitrophenyl]ethan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO3S
InChI InChI=1S/C9H9NO3S/c1-6(11)8-5-7(10(12)13)3-4-9(8)14-2/h3-5H,1-2H3
InChIKey JUSPIIZYFLLBBK-UHFFFAOYSA-N
Molecular Weight 211.235 g/mol
SMILES CSc1ccc(cc1C(=O)C)N(=O)=O
SPLASH splash10-0002-4920000000-e22d49a04526fb9d38a9
Source of Spectrum AD-0-2532-0
Synonyms 1-(2-Methylsulfanyl-5-nitro-phenyl)ethanone 1-[2-(methylthio)-5-nitro-phenyl]ethanone 1-[2-(methylthio)-5-nitrophenyl]ethanone
Wiley ID 1427443