CID 2771642

3-(trimethylsilyl)ethynylbenzaldehyde

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
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

No literature data available for this compound.

Patent stripe

patents stripe