CID 14479

1190-16-5

Structural Information

Molecular Formula
C5H9Cl2NSi
SMILES
C[Si](CCCC#N)(Cl)Cl
InChI
InChI=1S/C5H9Cl2NSi/c1-9(6,7)5-3-2-4-8/h2-3,5H2,1H3
InChIKey
UIFBMBZYGZSWQE-UHFFFAOYSA-N
Compound name
4-[dichloro(methyl)silyl]butanenitrile
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

650
Patents

180.98813 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.99541 134.8
[M+Na]+ 203.97735 145.6
[M-H]- 179.98085 135.4
[M+NH4]+ 199.02195 154.8
[M+K]+ 219.95129 141.5
[M+H-H2O]+ 163.98539 126.0
[M+HCOO]- 225.98633 145.2
[M+CH3COO]- 240.00198 190.3
[M+Na-2H]- 201.96280 140.8
[M]+ 180.98758 133.0
[M]- 180.98868 133.0
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