CID 21093331

4-(trimethylsilyl)diphenylacetylene

Structural Information

Molecular Formula
C17H18Si
SMILES
C[Si](C)(C)C1=CC=C(C=C1)C#CC2=CC=CC=C2
InChI
InChI=1S/C17H18Si/c1-18(2,3)17-13-11-16(12-14-17)10-9-15-7-5-4-6-8-15/h4-8,11-14H,1-3H3
InChIKey
UZRJWRFLYPENFH-UHFFFAOYSA-N
Compound name
trimethyl-[4-(2-phenylethynyl)phenyl]silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

86
Patents

250.11778 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.12506 164.1
[M+Na]+ 273.10700 173.9
[M-H]- 249.11050 168.3
[M+NH4]+ 268.15160 179.9
[M+K]+ 289.08094 166.4
[M+H-H2O]+ 233.11504 151.2
[M+HCOO]- 295.11598 179.9
[M+CH3COO]- 309.13163 199.8
[M+Na-2H]- 271.09245 168.1
[M]+ 250.11723 158.1
[M]- 250.11833 158.1
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