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2-[(o-Aminophenyl)thio]-N-(2-chloro-6-fluorophenyl)succinimide
SpectraBase Compound ID 5fES5HJcBom
InChI InChI=1S/C16H12ClFN2O2S/c17-9-4-3-5-10(18)15(9)20-14(21)8-13(16(20)22)23-12-7-2-1-6-11(12)19/h1-7,13H,8,19H2
InChIKey LDVZASOULQWVIU-UHFFFAOYSA-N
Mol Weight 350.8 g/mol
Molecular Formula C16H12ClFN2O2S
Exact Mass 350.029205 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CUFDwv286ET
Name 2-[(o-Aminophenyl)thio]-N-(2-chloro-6-fluorophenyl)succinimide
Comments Computed using HOSE algorithm
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Exact Mass 350.029204669 u
Formula C16H12ClFN2O2S
InChI InChI=1S/C16H12ClFN2O2S/c17-9-4-3-5-10(18)15(9)20-14(21)8-13(16(20)22)23-12-7-2-1-6-11(12)19/h1-7,13H,8,19H2
InChIKey LDVZASOULQWVIU-UHFFFAOYSA-N
Molecular Weight 350.795 g/mol
SMILES NC=1C(=CC=CC1)SC1CC(N(C1=O)C=1C(=CC=CC1F)Cl)=O