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1-(4'-Methoxyphenyl)-3-(4'-methoxyphenyl)ethynyl]-4-[(4'-nitrophenyl)ethynyl]-6-(triisopropylsilyl)hex-3-ene-1,5-diyne
SpectraBase Compound ID 1526aMJdXT8
InChI InChI=1S/C39H39NO4Si/c1-29(2)45(30(3)4,31(5)6)28-27-36(20-11-32-12-21-37(22-13-32)40(41)42)35(18-9-33-14-23-38(43-7)24-15-33)19-10-34-16-25-39(44-8)26-17-34/h12-17,21-26,29-31H,1-8H3
InChIKey PLLDIZWAWJHGHZ-UHFFFAOYSA-N
Mol Weight 613.8 g/mol
Molecular Formula C39H39NO4Si
Exact Mass 613.264835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BscGoHjKP4I
Name 1-(4'-Methoxyphenyl)-3-(4'-methoxyphenyl)ethynyl]-4-[(4'-nitrophenyl)ethynyl]-6-(triisopropylsilyl)hex-3-ene-1,5-diyne
Alternate Name(s) triisopropyl{6-(4-methoxyphenyl)-4-[(4-methoxyphenyl)ethynyl]-3-[(4-nitrophenyl)ethynyl]-3-hexene-1,5-diynyl}silane
Comments Less than 3 mono-isotopic peaks
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Formula C39H39NO4Si
InChI InChI=1S/C39H39NO4Si/c1-29(2)45(30(3)4,31(5)6)28-27-36(20-11-32-12-21-37(22-13-32)40(41)42)35(18-9-33-14-23-38(43-7)24-15-33)19-10-34-16-25-39(44-8)26-17-34/h12-17,21-26,29-31H,1-8H3
InChIKey PLLDIZWAWJHGHZ-UHFFFAOYSA-N
Molecular Weight 613.829 g/mol
SMILES C(#CC(C#Cc1ccc(N(=O)=O)cc1)=C(C#Cc1ccc(cc1)OC)C#Cc1ccc(cc1)OC)[Si](C(C)C)(C(C)C)C(C)C
SPLASH splash10-001i-0900001000-d63022f835e0d9185d55
Source of Spectrum H-79-2273-22
Wiley ID 1411143