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(Z)-3-(p-Nitrostyryl)-2-(p-tolylsulfonyl)-1-phenyl-1-phenylseleno-1-buten-3-ol
SpectraBase Compound ID BBTLXOEa7HF
InChI InChI=1S/C31H27NO5SSe/c1-23-13-19-27(20-14-23)38(36,37)30(31(2,33)22-21-24-15-17-26(18-16-24)32(34)35)29(25-9-5-3-6-10-25)39-28-11-7-4-8-12-28/h3-22,33H,1-2H3/b22-21+,30-29-
InChIKey XYMIDVPPHPTEFT-KUYAVTFKSA-N
Mol Weight 604.59 g/mol
Molecular Formula C31H27NO5SSe
Exact Mass 605.077516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKWIjGGGa4r
Name (Z)-3-(p-Nitrostyryl)-2-(p-tolylsulfonyl)-1-phenyl-1-phenylseleno-1-buten-3-ol
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Formula C31H27NO5SSe
InChI InChI=1S/C31H27NO5SSe/c1-23-13-19-27(20-14-23)38(36,37)30(31(2,33)22-21-24-15-17-26(18-16-24)32(34)35)29(25-9-5-3-6-10-25)39-28-11-7-4-8-12-28/h3-22,33H,1-2H3/b22-21+,30-29-
InChIKey XYMIDVPPHPTEFT-KUYAVTFKSA-N
Molecular Weight 604.591 g/mol
SMILES OC(\C(=C/([Se]c1ccccc1)c1ccccc1)S(=O)(=O)c1ccc(cc1)C)(C)\C=C\c1ccc(cc1)N(=O)=O
SPLASH splash10-0006-9010000000-77bb1b2c1ce33cbd3301
Source of Spectrum F-67-8899-12
Synonyms (1Z,4E)-3-methyl-2-(4-methylphenyl)sulfonyl-5-(4-nitrophenyl)-1-phenyl-1-(phenylseleno)-3-penta-1,4-dienol (1Z,4E)-3-methyl-2-(4-methylphenyl)sulfonyl-5-(4-nitrophenyl)-1-phenyl-1-phenylselanyl-penta-1,4-dien-3-ol (1Z,4E)-3-methyl-2-[(4-methylphenyl)sulfonyl]-5-(4-nitrophenyl)-1-phenyl-1-(phenylselanyl)-1,4-pentadien-3-ol (1Z,4E)-3-methyl-5-(4-nitrophenyl)-1-phenyl-1-(phenylseleno)-2-tosyl-penta-1,4-dien-3-ol (1Z,4E)-3-methyl-5-(4-nitrophenyl)-1-phenyl-1-phenylselanyl-2-(p-tolylsulfonyl)penta-1,4-dien-3-ol
Wiley ID 1571403