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N,4,5-Trimethyl-N-phenyl-2-(phenylsulfinyl)aniline
SpectraBase Compound ID 60twY1YIQU
InChI InChI=1S/C21H21NOS/c1-16-14-20(22(3)18-10-6-4-7-11-18)21(15-17(16)2)24(23)19-12-8-5-9-13-19/h4-15H,1-3H3
InChIKey VMEHOCBIXNDRFF-UHFFFAOYSA-N
Mol Weight 335.47 g/mol
Molecular Formula C21H21NOS
Exact Mass 335.134385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3S0IdYzQJc
Name N,4,5-Trimethyl-N-phenyl-2-(phenylsulfinyl)aniline
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.134385473 u
Formula C21H21NOS
InChI InChI=1S/C21H21NOS/c1-16-14-20(22(3)18-10-6-4-7-11-18)21(15-17(16)2)24(23)19-12-8-5-9-13-19/h4-15H,1-3H3
InChIKey VMEHOCBIXNDRFF-UHFFFAOYSA-N
Instrument Name Finnigan SSQ Finnigan 7000
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.3c00012
Molecular Weight 335.465 g/mol
Reported Formula C21H21ONS
SMILES C1(=CC(=C(C=C1C)S(=O)C1=CC=CC=C1)N(C1=CC=CC=C1)C)C
SPLASH splash10-014i-0009000000-1178f8381c6ad92d25c6
Source of Spectrum JOC-88-SM15-3ab (DOI: 10.1021/acs.joc.3c00012)
Wiley ID 1912678