CID 3051861

1-(2-furyl)silatrane

Structural Information

Molecular Formula
C10H15NO4Si
SMILES
C1CO[Si]2(OCCN1CCO2)C3=CC=CO3
InChI
InChI=1S/C10H15NO4Si/c1-2-10(12-6-1)16-13-7-3-11(4-8-14-16)5-9-15-16/h1-2,6H,3-5,7-9H2
InChIKey
QXZVYVKBVRCKKG-UHFFFAOYSA-N
Compound name
1-(furan-2-yl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.07704 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.08432 114.8
[M+Na]+ 264.06626 114.8
[M-H]- 240.06976 114.8
[M+NH4]+ 259.11086 114.8
[M+K]+ 280.04020 114.8
[M+H-H2O]+ 224.07430 114.7
[M+HCOO]- 286.07524 114.7
[M+CH3COO]- 300.09089 114.7
[M+Na-2H]- 262.05171 114.6
[M]+ 241.07649 114.7
[M]- 241.07759 114.7
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

No patent data available for this compound.