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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2LSMNImIEV4
Name 2-Benzylsulfinyl-4,6-diphenoxybenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
SMILES C(c1c(cc(cc1Oc1ccccc1)Oc1ccccc1)S(=O)Cc1ccccc1)#N
SPLASH splash10-0006-9000000000-467755268caaa6188558
Source of Spectrum H1-68-1116-9
Synonyms 2,4-Diphenoxy-6-(phenylmethyl)sulfinyl-benzenecarbonitrile 2,4-Diphenoxy-6-(phenylmethyl)sulfinylbenzonitrile 2-Benzylsulfinyl-4,6-diphenoxy-benzonitrile
Wiley ID 1593550