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2-[2-[2-(2-mesitylethynyl)-3-methoxy-cyclohexen-1-yl]ethynyl]-1,3,5-trimethyl-benzene
SpectraBase Compound ID A5v1t5NKpkE
InChI InChI=1S/C29H32O/c1-19-15-21(3)26(22(4)16-19)12-11-25-9-8-10-29(30-7)28(25)14-13-27-23(5)17-20(2)18-24(27)6/h15-18,29H,8-10H2,1-7H3
InChIKey FAKGEEBBPAHTIO-UHFFFAOYSA-N
Mol Weight 396.6 g/mol
Molecular Formula C29H32O
Exact Mass 396.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H9MIH6qTuZB
Name 2-[2-[2-(2-mesitylethynyl)-3-methoxy-cyclohexen-1-yl]ethynyl]-1,3,5-trimethyl-benzene
Alternate Name(s) 2-[2-[3-methoxy-2-[2-(2,4,6-trimethylphenyl)ethynyl]-1-cyclohexenyl]ethynyl]-1,3,5-trimethylbenzene 2-[2-[3-methoxy-2-[2-(2,4,6-trimethylphenyl)ethynyl]cyclohexen-1-yl]ethynyl]-1,3,5-trimethyl-benzene
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Formula C29H32O
InChI InChI=1S/C29H32O/c1-19-15-21(3)26(22(4)16-19)12-11-25-9-8-10-29(30-7)28(25)14-13-27-23(5)17-20(2)18-24(27)6/h15-18,29H,8-10H2,1-7H3
InChIKey FAKGEEBBPAHTIO-UHFFFAOYSA-N
Molecular Weight 396.574 g/mol
SMILES C1(=C(C(CCC1)OC)C#Cc1c(C)cc(C)cc1C)C#Cc1c(C)cc(C)cc1C
SPLASH splash10-0002-0009000000-dde8aba644af93c5fd3c
Source of Spectrum U-1997-1398-5
Wiley ID 770002