CID 86639

2-triethoxysilylpropanenitrile

Structural Information

Molecular Formula
C9H19NO3Si
SMILES
CCO[Si](C(C)C#N)(OCC)OCC
InChI
InChI=1S/C9H19NO3Si/c1-5-11-14(12-6-2,13-7-3)9(4)8-10/h9H,5-7H2,1-4H3
InChIKey
DXYXZPDAEJYSJL-UHFFFAOYSA-N
Compound name
2-triethoxysilylpropanenitrile
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

193
Patents

217.11342 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.12070 145.9
[M+Na]+ 240.10264 153.4
[M-H]- 216.10614 146.4
[M+NH4]+ 235.14724 163.4
[M+K]+ 256.07658 154.3
[M+H-H2O]+ 200.11068 134.5
[M+HCOO]- 262.11162 163.6
[M+CH3COO]- 276.12727 199.4
[M+Na-2H]- 238.08809 150.4
[M]+ 217.11287 146.5
[M]- 217.11397 146.5
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