CID 4431629

5-[(trimethylsilyl)ethynyl])-1-methylimidazole

Structural Information

Molecular Formula
C9H14N2Si
SMILES
CN1C=NC=C1C#C[Si](C)(C)C
InChI
InChI=1S/C9H14N2Si/c1-11-8-10-7-9(11)5-6-12(2,3)4/h7-8H,1-4H3
InChIKey
ZNCKMUMVQDCZBO-UHFFFAOYSA-N
Compound name
trimethyl-[2-(3-methylimidazol-4-yl)ethynyl]silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

178.09262 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.09990 139.3
[M+Na]+ 201.08184 149.6
[M-H]- 177.08534 138.6
[M+NH4]+ 196.12644 157.1
[M+K]+ 217.05578 146.6
[M+H-H2O]+ 161.08988 126.1
[M+HCOO]- 223.09082 154.2
[M+CH3COO]- 237.10647 187.0
[M+Na-2H]- 199.06729 143.2
[M]+ 178.09207 134.6
[M]- 178.09317 134.6
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