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2-[(4-Nitrophenyl)sulfanyl]-1-phenylethanone
SpectraBase Compound ID CSjwBCz4Gti
InChI InChI=1S/C14H11NO3S/c16-14(11-4-2-1-3-5-11)10-19-13-8-6-12(7-9-13)15(17)18/h1-9H,10H2
InChIKey MSDOBISTMBKIFE-UHFFFAOYSA-N
Mol Weight 273.31 g/mol
Molecular Formula C14H11NO3S
Exact Mass 273.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 40pCnre9Odv
Name 2-[(4-Nitrophenyl)sulfanyl]-1-phenylethanone
Alternate Name(s) 2-((4-nitrophenyl)thio)-1-phenylethan-1-one
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Formula C14H11NO3S
InChI InChI=1S/C14H11NO3S/c16-14(11-4-2-1-3-5-11)10-19-13-8-6-12(7-9-13)15(17)18/h1-9H,10H2
InChIKey MSDOBISTMBKIFE-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.200900393
Molecular Weight 273.306 g/mol
SMILES C(c1ccccc1)(=O)CSc1ccc(cc1)[N+](=O)[O-]
SPLASH splash10-0a4i-3900000000-c2eada3959bbedeebe43
Source of Spectrum H-93-1615-2d
Wiley ID 1784042