CID 17830060

4-(tributylstannyl)pyrimidine

Structural Information

Molecular Formula
C16H30N2Sn
SMILES
CCCC[Sn](CCCC)(CCCC)C1=NC=NC=C1
InChI
InChI=1S/C4H3N2.3C4H9.Sn/c1-2-5-4-6-3-1;3*1-3-4-2;/h1-2,4H;3*1,3-4H2,2H3;
InChIKey
HQMLIWXIPSYXMY-UHFFFAOYSA-N
Compound name
tributyl(pyrimidin-4-yl)stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

429
Patents

370.1431 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.150376 191.2
[M+Na]+ 393.132318 194.8
[M-H]- 369.135824 189.6
[M+NH4]+ 388.176923 204.2
[M+K]+ 409.106258 190.4
[M+H-H2O]+ 353.140360 181.4
[M+HCOO]- 415.141301 207.6
[M+CH3COO]- 429.156951 205.3
[M+Na-2H]- 391.117766 193.5
[M]+ 370.14255142 194.5
[M]- 370.14364858 194.5
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