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2-Benzylsulfonyl-4,6-diphenoxy-benzonitrile

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

2-Benzylsulfonyl-4,6-diphenoxy-benzonitrile
SpectraBase Compound ID 9FzVz9rZTJf
InChI InChI=1S/C26H19NO4S/c27-18-24-25(31-22-14-8-3-9-15-22)16-23(30-21-12-6-2-7-13-21)17-26(24)32(28,29)19-20-10-4-1-5-11-20/h1-17H,19H2
InChIKey KRLGAXWPQGNKFX-UHFFFAOYSA-N
Mol Weight 441.5 g/mol
Molecular Formula C26H19NO4S
Exact Mass 441.103479 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5tIfsmbKhvL
Name benzonitrile, 2,4-diphenoxy-6-[(phenylmethyl)sulfonyl]-
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 441.103479266 u
Formula C26H19NO4S
InChI InChI=1S/C26H19NO4S/c27-18-24-25(31-22-14-8-3-9-15-22)16-23(30-21-12-6-2-7-13-21)17-26(24)32(28,29)19-20-10-4-1-5-11-20/h1-17H,19H2
InChIKey KRLGAXWPQGNKFX-UHFFFAOYSA-N
Molecular Weight 441.501 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13451
Solvent DMSO-d6
Source Vendor ID: NMR/10270478; Lab Info: L-17; Lab Number: Kislitsyn,L-17