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2,4,6-Trichloro-3-nitro-5-trifluoromethylsulfonylaniline
SpectraBase Compound ID 1i83NBVVq2b
InChI InChI=1S/C7H2Cl3F3N2O4S/c8-1-4(14)2(9)6(3(10)5(1)15(16)17)20(18,19)7(11,12)13/h14H2
InChIKey JRAKPEUREWYWRJ-UHFFFAOYSA-N
Mol Weight 373.52 g/mol
Molecular Formula C7H2Cl3F3N2O4S
Exact Mass 371.875295 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfHEqieKugL
Name 2,4,6-Trichloro-3-nitro-5-trifluoromethylsulfonylaniline
Comments Less than 3 mono-isotopic peaks
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Formula C7H2Cl3F3N2O4S
InChI InChI=1S/C7H2Cl3F3N2O4S/c8-1-4(14)2(9)6(3(10)5(1)15(16)17)20(18,19)7(11,12)13/h14H2
InChIKey JRAKPEUREWYWRJ-UHFFFAOYSA-N
Molecular Weight 373.517 g/mol
SMILES Nc1c(c(c(c(c1Cl)S(=O)(=O)C(F)(F)F)Cl)N(=O)=O)Cl
SPLASH splash10-00di-0009000000-8469d5fa9e7bc3ce9052
Source of Spectrum QE-5-36-35
Synonyms 2,4,6-trichloro-3-nitro-5-[(trifluoromethyl)sulfonyl]phenylamine
Wiley ID 843973