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2-Benzylsulfinyl-4,6-diphenoxybenzonitrile

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

2-Benzylsulfinyl-4,6-diphenoxybenzonitrile
SpectraBase Compound ID HhqWfgomHmX
InChI InChI=1S/C26H19NO3S/c27-18-24-25(30-22-14-8-3-9-15-22)16-23(29-21-12-6-2-7-13-21)17-26(24)31(28)19-20-10-4-1-5-11-20/h1-17H,19H2
InChIKey XBSSRYFBBYABKP-UHFFFAOYSA-N
Mol Weight 425.5 g/mol
Molecular Formula C26H19NO3S
Exact Mass 425.108565 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DA4FylnTKG7
Name benzonitrile, 2,4-diphenoxy-6-[(phenylmethyl)sulfinyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 425.108564647 u
Formula C26H19NO3S
InChI InChI=1S/C26H19NO3S/c27-18-24-25(30-22-14-8-3-9-15-22)16-23(29-21-12-6-2-7-13-21)17-26(24)31(28)19-20-10-4-1-5-11-20/h1-17H,19H2
InChIKey XBSSRYFBBYABKP-UHFFFAOYSA-N
Molecular Weight 425.502 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15937
Solvent DMSO-d6
Source Vendor ID: NMR/10320847; Lab Info: L-12; Lab Number: ZLOT-0000003