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1,2-Bis[2-methyl-5-[3-(2,5-dimethylfuran-3-yl)-3-oxopropenyl]thiophen-3-yl]cyclopentene
SpectraBase Compound ID 7AhxflA9P5J
InChI InChI=1S/C33H32O4S2/c1-18-14-28(20(3)36-18)32(34)12-10-24-16-30(22(5)38-24)26-8-7-9-27(26)31-17-25(39-23(31)6)11-13-33(35)29-15-19(2)37-21(29)4/h10-17H,7-9H2,1-6H3/b12-10+,13-11+
InChIKey SXJCOGFTRFWMDE-DCIPZJNNSA-N
Mol Weight 556.7 g/mol
Molecular Formula C33H32O4S2
Exact Mass 556.174202 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HoqekzCKgoB
Name 1,2-Bis[2-methyl-5-[3-(2,5-dimethylfuran-3-yl)-3-oxopropenyl]thiophen-3-yl]cyclopentene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H32O4S2
InChI InChI=1S/C33H32O4S2/c1-18-14-28(20(3)36-18)32(34)12-10-24-16-30(22(5)38-24)26-8-7-9-27(26)31-17-25(39-23(31)6)11-13-33(35)29-15-19(2)37-21(29)4/h10-17H,7-9H2,1-6H3/b12-10+,13-11+
InChIKey SXJCOGFTRFWMDE-DCIPZJNNSA-N
Molecular Weight 556.735 g/mol
SMILES c1(C2=C(c3c(sc(c3)\C=C\C(c3c(oc(c3)C)C)=O)C)CCC2)c(sc(c1)\C=C\C(c1c(oc(c1)C)C)=O)C
SPLASH splash10-052f-0000090000-7224693edbdddcc7480f
Source of Spectrum U1-2010-6036-18
Synonyms (E)-1-(2,5-dimethyl-3-furanyl)-3-[4-[2-[5-[(E)-3-(2,5-dimethyl-3-furanyl)-3-oxoprop-1-enyl]-2-methyl-3-thiophenyl]-1-cyclopentenyl]-5-methyl-2-thiophenyl]-2-propen-1-one (E)-1-(2,5-dimethylfuran-3-yl)-3-[4-[2-[5-[(E)-3-(2,5-dimethylfuran-3-yl)-3-oxoprop-1-enyl]-2-methylthiophen-3-yl]cyclopenten-1-yl]-5-methylthiophen-2-yl]prop-2-en-1-one (E)-1-(2,5-dimethyl-3-furyl)-3-[4-[2-[5-[(E)-3-(2,5-dimethyl-3-furyl)-3-oxo-prop-1-enyl]-2-methyl-3-thienyl]cyclopenten-1-yl]-5-methyl-2-thienyl]prop-2-en-1-one (E)-1-(2,5-dimethylfuran-3-yl)-3-[4-[2-[5-[(E)-3-(2,5-dimethylfuran-3-yl)-3-oxidanylidene-prop-1-enyl]-2-methyl-thiophen-3-yl]cyclopenten-1-yl]-5-methyl-thiophen-2-yl]prop-2-en-1-one
Wiley ID 1664448