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2,6-Ditert-butyl-4-[(E)-2-[4-nitro-3-(p-tolylsulfonylmethyl)phenyl]-2-(p-tolylsulfonyl)vinyl]phenol
SpectraBase Compound ID EZm1ffkIVCT
InChI InChI=1S/C37H41NO7S2/c1-24-9-14-29(15-10-24)46(42,43)23-28-22-27(13-18-33(28)38(40)41)34(47(44,45)30-16-11-25(2)12-17-30)21-26-19-31(36(3,4)5)35(39)32(20-26)37(6,7)8/h9-22,39H,23H2,1-8H3/b34-21+
InChIKey UWNYIISKNQKNKC-KEIPNQJHSA-N
Mol Weight 675.9 g/mol
Molecular Formula C37H41NO7S2
Exact Mass 675.232445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Ou8TC1xLrQ
Name 2,6-Ditert-butyl-4-[(E)-2-[4-nitro-3-(p-tolylsulfonylmethyl)phenyl]-2-(p-tolylsulfonyl)vinyl]phenol
Alternate Name(s) 2,6-Ditert-butyl-4-[(E)-2-[4-nitro-3-(tosylmethyl)phenyl]-2-tosyl-vinyl]phenol 2,6-Ditert-butyl-4-[(E)-2-(4-methylphenyl)sulfonyl-2-[3-[(4-methylphenyl)sulfonylmethyl]-4-nitrophenyl]ethenyl]phenol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H41NO7S2
InChI InChI=1S/C37H41NO7S2/c1-24-9-14-29(15-10-24)46(42,43)23-28-22-27(13-18-33(28)38(40)41)34(47(44,45)30-16-11-25(2)12-17-30)21-26-19-31(36(3,4)5)35(39)32(20-26)37(6,7)8/h9-22,39H,23H2,1-8H3/b34-21+
InChIKey UWNYIISKNQKNKC-KEIPNQJHSA-N
Molecular Weight 675.855 g/mol
SMILES Oc1c(cc(cc1C(C)(C)C)\C=C/(S(=O)(=O)c1ccc(cc1)C)c1cc(c(cc1)N(=O)=O)CS(=O)(=O)c1ccc(cc1)C)C(C)(C)C
SPLASH splash10-0udi-2009002000-f82900fdf3dcd4280c80
Source of Spectrum F-62-2629-7
Wiley ID 1632607