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
2
Annotation Hits

0
References

15
Patents

488.196 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 489.203276 224.5
[M+Na]+ 511.185218 227.5
[M-H]- 487.188724 239.5
[M+NH4]+ 506.229823 228.9
[M+K]+ 527.159158 217.4
[M+H-H2O]+ 471.193260 209.5
[M+HCOO]- 533.194201 242.1
[M+CH3COO]- 547.209851 230.5
[M+Na-2H]- 509.170666 227.3
[M]+ 488.19545142 218.9
[M]- 488.19654858 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