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5'-(Benzo[d][1,3]dioxol-5-yl)-4''-((trimethylsilyl)ethynyl)-[1,1':3',1''-terphenyl]-4'-carbonitrile
SpectraBase Compound ID 1jnYEfOQfsD
InChI InChI=1S/C31H25NO2Si/c1-35(2,3)16-15-22-9-11-24(12-10-22)27-17-26(23-7-5-4-6-8-23)18-28(29(27)20-32)25-13-14-30-31(19-25)34-21-33-30/h4-14,17-19H,21H2,1-3H3
InChIKey JFEHTZPEGQSISL-UHFFFAOYSA-N
Mol Weight 471.63 g/mol
Molecular Formula C31H25NO2Si
Exact Mass 471.165456 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IdJK2cpp7Ph
Name 5'-(Benzo[d][1,3]dioxol-5-yl)-4''-((trimethylsilyl)ethynyl)-[1,1':3',1''-terphenyl]-4'-carbonitrile
Appearance Colorless solid
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Formula C31H25NO2Si
InChI InChI=1S/C31H25NO2Si/c1-35(2,3)16-15-22-9-11-24(12-10-22)27-17-26(23-7-5-4-6-8-23)18-28(29(27)20-32)25-13-14-30-31(19-25)34-21-33-30/h4-14,17-19H,21H2,1-3H3
InChIKey JFEHTZPEGQSISL-UHFFFAOYSA-N
Instrument Name FINNIGAN MAT 95Q or HEWLETT-PACKARD HP 6890-MSD 5973
Ionization Type EI
Literature Reference DOI 10.1002/chem.202103700
Molecular Weight 471.631 g/mol
Reported Formula C31H25NO2Si
SMILES C1(=C(C#N)C(C2=CC=C3C(OCO3)=C2)=CC(C2=CC=CC=C2)=C1)C1=CC=C(C#C[Si](C)(C)C)C=C1
SPLASH splash10-0ab9-0010900000-a32232702df278f50726
Source of Spectrum QE-28-SM80-5i (DOI: 10.1002/chem.202103700)
Wiley ID 1898253