CID 76636

3172-33-6

Structural Information

Molecular Formula
C36H28Si
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=C(C=C5)C6=CC=CC=C6
InChI
InChI=1S/C36H28Si/c1-5-13-29(14-6-1)31-21-25-35(26-22-31)37(33-17-9-3-10-18-33,34-19-11-4-12-20-34)36-27-23-32(24-28-36)30-15-7-2-8-16-30/h1-28H
InChIKey
HCKMRFVWQPVCFY-UHFFFAOYSA-N
Compound name
diphenyl-bis(4-phenylphenyl)silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

488.196 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 489.20328 224.5
[M+Na]+ 511.18522 227.5
[M-H]- 487.18872 239.5
[M+NH4]+ 506.22982 228.9
[M+K]+ 527.15916 217.4
[M+H-H2O]+ 471.19326 209.5
[M+HCOO]- 533.19420 242.1
[M+CH3COO]- 547.20985 230.5
[M+Na-2H]- 509.17067 227.3
[M]+ 488.19545 218.9
[M]- 488.19655 218.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe