CID 13522

919-31-3

Structural Information

Molecular Formula
C9H19NO3Si
SMILES
CCO[Si](CCC#N)(OCC)OCC
InChI
InChI=1S/C9H19NO3Si/c1-4-11-14(12-5-2,13-6-3)9-7-8-10/h4-7,9H2,1-3H3
InChIKey
GBQYMXVQHATSCC-UHFFFAOYSA-N
Compound name
3-triethoxysilylpropanenitrile
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

7
References

4275
Patents

217.11342 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.12070 144.9
[M+Na]+ 240.10264 152.6
[M-H]- 216.10614 145.3
[M+NH4]+ 235.14724 162.4
[M+K]+ 256.07658 153.0
[M+H-H2O]+ 200.11068 133.3
[M+HCOO]- 262.11162 163.4
[M+CH3COO]- 276.12727 198.6
[M+Na-2H]- 238.08809 150.6
[M]+ 217.11287 146.1
[M]- 217.11397 146.1
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