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2-[(2,4-Dinitrophenyl)thio]-p-acetanisidide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 UV-Vis

2-[(2,4-Dinitrophenyl)thio]-p-acetanisidide
SpectraBase Compound ID LmOWkJhO0IF
InChI InChI=1S/C15H13N3O6S/c1-24-12-5-2-10(3-6-12)16-15(19)9-25-14-7-4-11(17(20)21)8-13(14)18(22)23/h2-8H,9H2,1H3,(H,16,19)
InChIKey NUYWZBJWXMPFDW-UHFFFAOYSA-N
Mol Weight 363.34 g/mol
Molecular Formula C15H13N3O6S
Exact Mass 363.052506 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J1EuQhNafMd
Name 2-[(2,4-Dinitrophenyl)thio]-p-acetanisidide
Comments Computed using HOSE algorithm
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Exact Mass 363.052506319 u
Formula C15H13N3O6S
InChI InChI=1S/C15H13N3O6S/c1-24-12-5-2-10(3-6-12)16-15(19)9-25-14-7-4-11(17(20)21)8-13(14)18(22)23/h2-8H,9H2,1H3,(H,16,19)
InChIKey NUYWZBJWXMPFDW-UHFFFAOYSA-N
Molecular Weight 363.344 g/mol
SMILES N(C=1C=CC(=CC1)OC)C(CSC=1C(=CC(=CC1)N(=O)=O)N(=O)=O)=O