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Benzene, 1-methyl-4-[[4-phenyl-1-[2-(phenylseleno)ethyl]-1-butenyl]sulfonyl]-, (E)-
SpectraBase Compound ID DuDsyuLszb
InChI InChI=1S/C25H26O2SSe/c1-21-15-17-24(18-16-21)28(26,27)23(12-8-11-22-9-4-2-5-10-22)19-20-29-25-13-6-3-7-14-25/h2-7,9-10,12-18H,8,11,19-20H2,1H3/b23-12+
InChIKey VLNRVCOAKOCSDU-FSJBWODESA-N
Mol Weight 469.51 g/mol
Molecular Formula C25H26O2SSe
Exact Mass 470.081873 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dmx19fIjxGT
Name Benzene, 1-methyl-4-[[4-phenyl-1-[2-(phenylseleno)ethyl]-1-butenyl]sulfonyl]-, (E)-
CAS Registry Number 117754-20-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26O2SSe
InChI InChI=1S/C25H26O2SSe/c1-21-15-17-24(18-16-21)28(26,27)23(12-8-11-22-9-4-2-5-10-22)19-20-29-25-13-6-3-7-14-25/h2-7,9-10,12-18H,8,11,19-20H2,1H3/b23-12+
InChIKey VLNRVCOAKOCSDU-FSJBWODESA-N
Molecular Weight 469.513 g/mol
SMILES C(\C=C/(S(c1ccc(cc1)C)(=O)=O)CC[Se]c1ccccc1)Cc1ccccc1
SPLASH splash10-0006-9101000000-1b811b3aee6d50228c1d
Source of Spectrum J-54-125-11
Synonyms 1-Methyl-4-({(1E)-4-phenyl-1-[2-(phenylselanyl)ethyl]-1-butenyl}sulfonyl)benzene 4-Methylphenyl (1E)-4-phenyl-1-[2-(phenylselanyl)ethyl]-1-butenyl sulfone
Wiley ID 1392803