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5-Nitro-2-[(phenylsulfonyl)methyl]aniline
SpectraBase Compound ID CQ3RSw3R6q
InChI InChI=1S/C13H12N2O4S/c14-13-8-11(15(16)17)7-6-10(13)9-20(18,19)12-4-2-1-3-5-12/h1-8H,9,14H2
InChIKey JMOMMOBZNULMPI-UHFFFAOYSA-N
Mol Weight 292.31 g/mol
Molecular Formula C13H12N2O4S
Exact Mass 292.051778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E9Y3D8Zbsgh
Name 5-Nitro-2-[(phenylsulfonyl)methyl]aniline
Comments Less than 3 mono-isotopic peaks
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Formula C13H12N2O4S
InChI InChI=1S/C13H12N2O4S/c14-13-8-11(15(16)17)7-6-10(13)9-20(18,19)12-4-2-1-3-5-12/h1-8H,9,14H2
InChIKey JMOMMOBZNULMPI-UHFFFAOYSA-N
Molecular Weight 292.309 g/mol
SMILES Nc1c(ccc(c1)N(=O)=O)CS(=O)(=O)c1ccccc1
SPLASH splash10-0udi-0900000000-6c1e4c0465e64f80bbe6
Source of Spectrum KC-60-354-25
Synonyms 5-nitro-2-[(phenylsulfonyl)methyl]phenylamine
Wiley ID 1582999