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Benzene, 1,1'-[[3-methyl-4-(1-propenyl)-1-cyclohexene-1,4-diyl]bis(sulfonyl)]bis-, [3.alpha.,4.beta.,4(E)]-
SpectraBase Compound ID 5kXqYU1H1AR
InChI InChI=1S/C22H24O4S2/c1-3-15-22(28(25,26)20-12-8-5-9-13-20)16-14-21(17-18(22)2)27(23,24)19-10-6-4-7-11-19/h3-13,15,17-18H,14,16H2,1-2H3/b15-3+/t18-,22+/m1/s1
InChIKey FXWSIRNEMFSFNH-FTSPDGCHSA-N
Mol Weight 416.55 g/mol
Molecular Formula C22H24O4S2
Exact Mass 416.111602 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IzE6JUIb3vu
Name Benzene, 1,1'-[[3-methyl-4-(1-propenyl)-1-cyclohexene-1,4-diyl]bis(sulfonyl)]bis-, [3.alpha.,4.beta.,4(E)]-
CAS Registry Number 131233-24-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24O4S2
InChI InChI=1S/C22H24O4S2/c1-3-15-22(28(25,26)20-12-8-5-9-13-20)16-14-21(17-18(22)2)27(23,24)19-10-6-4-7-11-19/h3-13,15,17-18H,14,16H2,1-2H3/b15-3+/t18-,22+/m1/s1
InChIKey FXWSIRNEMFSFNH-FTSPDGCHSA-N
Molecular Weight 416.550 g/mol
SMILES [C@]1(S(=O)(=O)c2ccccc2)([C@@](C=C(S(=O)(=O)c2ccccc2)CC1)(C)[H])\C=C\C
SPLASH splash10-004i-2920000000-606bdee3330a04a433cd
Source of Spectrum F-46-5599-3
Synonyms ({(1R,2R)-2-methyl-4-(phenylsulfonyl)-1-[(1E)-1-propenyl]-3-cyclohexen-1-yl}sulfonyl)benzene 1,4-bis(benzesulfonyl)-4-(1-butenyl)-3-methyl-1-cyclohexene
Wiley ID 1376292