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4-((4-Bromophenyl)carbamoyl)phenyl trifluoromethanesulfonate
SpectraBase Compound ID 8yJPTZ6NMQx
InChI InChI=1S/C14H9BrF3NO4S/c15-10-3-5-11(6-4-10)19-13(20)9-1-7-12(8-2-9)23-24(21,22)14(16,17)18/h1-8H,(H,19,20)
InChIKey JTBACZGZPXSVKB-UHFFFAOYSA-N
Mol Weight 424.19 g/mol
Molecular Formula C14H9BrF3NO4S
Exact Mass 422.938776 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9fPu12SaJiH
Name 4-((4-Bromophenyl)carbamoyl)phenyl trifluoromethanesulfonate
Appearance White solid
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Exact Mass 422.938776433 u
Formula C14H9BrF3NO4S
InChI InChI=1S/C14H9BrF3NO4S/c15-10-3-5-11(6-4-10)19-13(20)9-1-7-12(8-2-9)23-24(21,22)14(16,17)18/h1-8H,(H,19,20)
InChIKey JTBACZGZPXSVKB-UHFFFAOYSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/chem.201702015
Molecular Weight 424.188 g/mol
Quality 212
Reported Formula C14H9O4N(79)BrF3S
SMILES N(C1=CC=C(Br)C=C1)C(=O)C1=CC=C(C=C1)OS(C(F)(F)F)(=O)=O
SPLASH splash10-0uxr-9280400000-a489888f5a84759a57b1
Source of Spectrum QE-23-13377-12 (DOI: 10.1002/chem.201702015)
Wiley ID 1905841