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1,2-Bis[2-methyl-5-(4,4-dimethyl-3-oxopentenyl)thiophen-3-yl]cyclopentene
SpectraBase Compound ID 48gPJAmXRtG
InChI InChI=1S/C29H36O2S2/c1-18-24(16-20(32-18)12-14-26(30)28(3,4)5)22-10-9-11-23(22)25-17-21(33-19(25)2)13-15-27(31)29(6,7)8/h12-17H,9-11H2,1-8H3/b14-12+,15-13+
InChIKey OLRXRRYSALXJLO-QUMQEAAQSA-N
Mol Weight 480.7 g/mol
Molecular Formula C29H36O2S2
Exact Mass 480.215673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5dTVnIGPxRp
Name 1,2-Bis[2-methyl-5-(4,4-dimethyl-3-oxopentenyl)thiophen-3-yl]cyclopentene
Alternate Name(s) (E)-1-[4-[2-[5-[(E)-4,4-dimethyl-3-oxopent-1-enyl]-2-methyl-3-thiophenyl]-1-cyclopentenyl]-5-methyl-2-thiophenyl]-4,4-dimethyl-1-penten-3-one (E)-1-[4-[2-[5-[(E)-4,4-dimethyl-3-oxopent-1-enyl]-2-methylthiophen-3-yl]cyclopenten-1-yl]-5-methylthiophen-2-yl]-4,4-dimethylpent-1-en-3-one (E)-1-[4-[2-[5-[(E)-4,4-dimethyl-3-oxo-pent-1-enyl]-2-methyl-3-thienyl]cyclopenten-1-yl]-5-methyl-2-thienyl]-4,4-dimethyl-pent-1-en-3-one (E)-1-[4-[2-[5-[(E)-4,4-dimethyl-3-oxidanylidene-pent-1-enyl]-2-methyl-thiophen-3-yl]cyclopenten-1-yl]-5-methyl-thiophen-2-yl]-4,4-dimethyl-pent-1-en-3-one
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Formula C29H36O2S2
InChI InChI=1S/C29H36O2S2/c1-18-24(16-20(32-18)12-14-26(30)28(3,4)5)22-10-9-11-23(22)25-17-21(33-19(25)2)13-15-27(31)29(6,7)8/h12-17H,9-11H2,1-8H3/b14-12+,15-13+
InChIKey OLRXRRYSALXJLO-QUMQEAAQSA-N
Molecular Weight 480.725 g/mol
SMILES c1(C2=C(c3c(sc(c3)\C=C\C(C(C)(C)C)=O)C)CCC2)c(sc(c1)\C=C\C(C(C)(C)C)=O)C
SPLASH splash10-00e9-0000900000-ffdbe015c06364278f49
Source of Spectrum U1-2010-6036-11
Wiley ID 1664455