CID 218956

1-(2-thienyl)silatrane

Structural Information

Molecular Formula
C10H15NO3SSi
SMILES
C1CO[Si]2(OCCN1CCO2)C3=CC=CS3
InChI
InChI=1S/C10H15NO3SSi/c1-2-10(15-9-1)16-12-6-3-11(4-7-13-16)5-8-14-16/h1-2,9H,3-8H2
InChIKey
GEBJEDOKPRVAJU-UHFFFAOYSA-N
Compound name
1-thiophen-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

257.0542 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.06148 169.9
[M+Na]+ 280.04342 169.9
[M+NH4]+ 275.08802 169.9
[M+K]+ 296.01736 169.9
[M-H]- 256.04692 169.9
[M+Na-2H]- 278.02887 169.9
[M]+ 257.05365 169.9
[M]- 257.05475 169.9
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.