CID 5213428

Bis(phenylethynyl)diphenylsilane

Structural Information

Molecular Formula
C28H20Si
SMILES
C1=CC=C(C=C1)C#C[Si](C#CC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C28H20Si/c1-5-13-25(14-6-1)21-23-29(27-17-9-3-10-18-27,28-19-11-4-12-20-28)24-22-26-15-7-2-8-16-26/h1-20H
InChIKey
BBVOORFIXBLFFX-UHFFFAOYSA-N
Compound name
diphenyl-bis(2-phenylethynyl)silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

384.13342 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.14070 211.0
[M+Na]+ 407.12264 220.9
[M-H]- 383.12614 214.7
[M+NH4]+ 402.16724 217.1
[M+K]+ 423.09658 206.0
[M+H-H2O]+ 367.13068 193.3
[M+HCOO]- 429.13162 217.3
[M+CH3COO]- 443.14727 213.8
[M+Na-2H]- 405.10809 209.4
[M]+ 384.13287 198.9
[M]- 384.13397 198.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe