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2-(4'-Methoxyphenyl)-6-[(4'-cyanophenyl]-4,4-diphenyl-4H-thiopyran
SpectraBase Compound ID 8Q69KjpKwK4
InChI InChI=1S/C31H23NOS/c1-33-28-18-16-25(17-19-28)30-21-31(26-8-4-2-5-9-26,27-10-6-3-7-11-27)20-29(34-30)24-14-12-23(22-32)13-15-24/h2-21H,1H3
InChIKey ATLXXPCABNGMIJ-UHFFFAOYSA-N
Mol Weight 457.59 g/mol
Molecular Formula C31H23NOS
Exact Mass 457.150036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVlCXRONIOs
Name 2-(4'-Methoxyphenyl)-6-[(4'-cyanophenyl]-4,4-diphenyl-4H-thiopyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H23NOS
InChI InChI=1S/C31H23NOS/c1-33-28-18-16-25(17-19-28)30-21-31(26-8-4-2-5-9-26,27-10-6-3-7-11-27)20-29(34-30)24-14-12-23(22-32)13-15-24/h2-21H,1H3
InChIKey ATLXXPCABNGMIJ-UHFFFAOYSA-N
Molecular Weight 457.591 g/mol
SMILES C1(C=C(c2ccc(C#N)cc2)SC(=C1)c1ccc(cc1)OC)(c1ccccc1)c1ccccc1
SPLASH splash10-0a59-0307900000-d690b489734d0ca71bdc
Source of Spectrum G-63-672-24
Wiley ID 749395