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4',NITRO-alpha,alpha,alpha-TRIFLUORO-m-TRIDECANOTOLUIDIDE
SpectraBase Compound ID GQcj2mKPTzB
InChI InChI=1S/C20H29F3N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-19(26)24-16-13-14-18(25(27)28)17(15-16)20(21,22)23/h13-15H,2-12H2,1H3,(H,24,26)
InChIKey LOBVRLORGKLLHM-UHFFFAOYSA-N
Mol Weight 402.46 g/mol
Molecular Formula C20H29F3N2O3
Exact Mass 402.213027 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID InUStn9UX2L
Name 4',nitro-alpha,alpha,alpha-trifluoro-m-tridecanotoluidide
Source of Sample J. W. Baker, Monsanto Company, Organic Chemicals Division, St. Louis, Missouri
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Formula C20H29F3N2O3
InChI InChI=1S/C20H29F3N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-19(26)24-16-13-14-18(25(27)28)17(15-16)20(21,22)23/h13-15H,2-12H2,1H3,(H,24,26)
InChIKey LOBVRLORGKLLHM-UHFFFAOYSA-N
Instrument Name Varian A-60
Literature Reference JMCH 10, 93(1967)
Sadtler NMR Number 6249M
Solvent CDCl3
Synonyms M-TRIDECANOTOLUIDIDE, 4*-NITRO-A,A,A- TRIFLUORO-,