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methyl p-nitrophenyl sulfide
SpectraBase Compound ID 5gFirMLGfpi
InChI InChI=1S/C7H7NO2S/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3
InChIKey NEZGPRYOJVPJKL-UHFFFAOYSA-N
Mol Weight 169.2 g/mol
Molecular Formula C7H7NO2S
Exact Mass 169.01975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C58qZ6npQNN
Name 1-(Methylsulfanyl)-4-nitrobenzene
CAS Registry Number 701-57-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7NO2S
InChI InChI=1S/C7H7NO2S/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3
InChIKey NEZGPRYOJVPJKL-UHFFFAOYSA-N
Molecular Weight 169.198 g/mol
SMILES c1(N(=O)=O)ccc(SC)cc1
SPLASH splash10-014r-7900000000-834fcc3a9ed1839c29cc
Source of Spectrum W5-1989-37814-27722
Synonyms 1-(methylthio)-4-nitro-benzene 4-Nitrothioanisole Benzene, 1-(methylthio)-4-nitro- Methyl 4-nitrophenyl sulfide Methyl 4-nitrophenyl sulphide 1-(methylthio)-4-nitrobenzene 1-Methylsulfanyl-4-nitrobenzene NSC 525300 NSC 53158
Wiley ID 1165625