CID 76878

3352-54-3

Structural Information

Molecular Formula
C48H36Si
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)[Si](C3=CC=C(C=C3)C4=CC=CC=C4)(C5=CC=C(C=C5)C6=CC=CC=C6)C7=CC=C(C=C7)C8=CC=CC=C8
InChI
InChI=1S/C48H36Si/c1-5-13-37(14-6-1)41-21-29-45(30-22-41)49(46-31-23-42(24-32-46)38-15-7-2-8-16-38,47-33-25-43(26-34-47)39-17-9-3-10-18-39)48-35-27-44(28-36-48)40-19-11-4-12-20-40/h1-36H
InChIKey
ABITWCWTLOLPCV-UHFFFAOYSA-N
Compound name
tetrakis(4-phenylphenyl)silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

640.2586 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 641.26588 264.2
[M+Na]+ 663.24782 265.0
[M-H]- 639.25132 281.8
[M+NH4]+ 658.29242 260.9
[M+K]+ 679.22176 253.6
[M+H-H2O]+ 623.25586 245.1
[M+HCOO]- 685.25680 277.6
[M+CH3COO]- 699.27245 265.9
[M+Na-2H]- 661.23327 262.5
[M]+ 640.25805 256.0
[M]- 640.25915 256.0
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