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N-Methyl-N-phenyl-3-(phenylsulfinyl)-[1,1'-biphenyl]-4-amine
SpectraBase Compound ID LYibGvqx7y7
InChI InChI=1S/C25H21NOS/c1-26(22-13-7-3-8-14-22)24-18-17-21(20-11-5-2-6-12-20)19-25(24)28(27)23-15-9-4-10-16-23/h2-19H,1H3
InChIKey OHOCYVLXKQQESO-UHFFFAOYSA-N
Mol Weight 383.51 g/mol
Molecular Formula C25H21NOS
Exact Mass 383.134385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QLjbrE9Zi2
Name N-Methyl-N-phenyl-3-(phenylsulfinyl)-[1,1'-biphenyl]-4-amine
Appearance Light yellow oil
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Exact Mass 383.134385473 u
Formula C25H21NOS
InChI InChI=1S/C25H21NOS/c1-26(22-13-7-3-8-14-22)24-18-17-21(20-11-5-2-6-12-20)19-25(24)28(27)23-15-9-4-10-16-23/h2-19H,1H3
InChIKey OHOCYVLXKQQESO-UHFFFAOYSA-N
Instrument Name Finnigan SSQ Finnigan 7000
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.3c00012
Molecular Weight 383.509 g/mol
Quality 283
Reported Formula C25H21ONS
SMILES C1=CC(=C(C=C1C1=CC=CC=C1)S(=O)C1=CC=CC=C1)N(C1=CC=CC=C1)C
SPLASH splash10-016r-2269000000-b1bd6f83b3d765afa845
Source of Spectrum JOC-88-SM17-3af (DOI: 10.1021/acs.joc.3c00012)
Thin-Layer Chromatography 0.6 (n-pentane/ethyl acetate, 4:1)
Wiley ID 1912684