CID 2771643

4-(trimethylsilylethynyl)benzaldehyde

Structural Information

Molecular Formula
C12H14OSi
SMILES
C[Si](C)(C)C#CC1=CC=C(C=C1)C=O
InChI
InChI=1S/C12H14OSi/c1-14(2,3)9-8-11-4-6-12(10-13)7-5-11/h4-7,10H,1-3H3
InChIKey
UZQDUXAJFTWMDT-UHFFFAOYSA-N
Compound name
4-(2-trimethylsilylethynyl)benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

279
Patents

202.08139 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.08867 147.3
[M+Na]+ 225.07061 157.6
[M-H]- 201.07411 149.7
[M+NH4]+ 220.11521 165.3
[M+K]+ 241.04455 153.1
[M+H-H2O]+ 185.07865 136.0
[M+HCOO]- 247.07959 163.9
[M+CH3COO]- 261.09524 191.1
[M+Na-2H]- 223.05606 152.0
[M]+ 202.08084 143.0
[M]- 202.08194 143.0
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