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2-o-Tolyl-1-tosyl-1H-benzimidazole
SpectraBase Compound ID L0zwIfSuzyo
InChI InChI=1S/C21H18N2O2S/c1-15-11-13-17(14-12-15)26(24,25)23-20-10-6-5-9-19(20)22-21(23)18-8-4-3-7-16(18)2/h3-14H,1-2H3
InChIKey FAYDOQHGUUBZNF-UHFFFAOYSA-N
Mol Weight 362.45 g/mol
Molecular Formula C21H18N2O2S
Exact Mass 362.108899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xPSK1usVlx
Name 2-o-Tolyl-1-tosyl-1H-benzimidazole
Appearance Colorless needles
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.108899000 u
Formula C21H18N2O2S
InChI InChI=1S/C21H18N2O2S/c1-15-11-13-17(14-12-15)26(24,25)23-20-10-6-5-9-19(20)22-21(23)18-8-4-3-7-16(18)2/h3-14H,1-2H3
InChIKey FAYDOQHGUUBZNF-UHFFFAOYSA-N
Instrument Name Agilent 5977E Diff-SST MSD-230V
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.18.155
Molecular Weight 362.447 g/mol
Quality 85
Reported Formula C21H18N2O2S
SMILES C=1C=CC=2N(C(=NC2C1)C1=C(C=CC=C1)C)S(C1=CC=C(C=C1)C)(=O)=O
SPLASH splash10-0a4i-1090000000-b7986e5dfb60bbb52a73
Source of Spectrum BJO-18-SM10-16e (DOI: 10.3762/bjoc.18.155)
Thin-Layer Chromatography 0.3 (Hexane/EtOAc, 8:2)
Wiley ID 1901236