CID 87557

(trimethylsilyl)acetonitrile

Structural Information

Molecular Formula
C5H11NSi
SMILES
C[Si](C)(C)CC#N
InChI
InChI=1S/C5H11NSi/c1-7(2,3)5-4-6/h5H2,1-3H3
InChIKey
WJKMUGYQMMXILX-UHFFFAOYSA-N
Compound name
2-trimethylsilylacetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

794
Patents

113.06608 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.07336 122.2
[M+Na]+ 136.05530 131.7
[M-H]- 112.05880 123.5
[M+NH4]+ 131.09990 143.7
[M+K]+ 152.02924 131.7
[M+H-H2O]+ 96.063340 112.1
[M+HCOO]- 158.06428 141.3
[M+CH3COO]- 172.07993 182.6
[M+Na-2H]- 134.04075 129.6
[M]+ 113.06553 118.2
[M]- 113.06663 118.2
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