CID 14976304

4-chloro-2-(tributylstannyl)pyrimidine

Structural Information

Molecular Formula
C16H29ClN2Sn
SMILES
CCCC[Sn](CCCC)(CCCC)C1=NC=CC(=N1)Cl
InChI
InChI=1S/C4H2ClN2.3C4H9.Sn/c5-4-1-2-6-3-7-4;3*1-3-4-2;/h1-2H;3*1,3-4H2,2H3;
InChIKey
LYCLDHXYCXTOCU-UHFFFAOYSA-N
Compound name
tributyl-(4-chloropyrimidin-2-yl)stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

404.10413 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.11141 196.6
[M+Na]+ 427.09335 201.8
[M-H]- 403.09685 195.2
[M+NH4]+ 422.13795 209.3
[M+K]+ 443.06729 195.5
[M+H-H2O]+ 387.10139 187.4
[M+HCOO]- 449.10233 208.3
[M+CH3COO]- 463.11798 210.0
[M+Na-2H]- 425.07880 197.7
[M]+ 404.10358 202.1
[M]- 404.10468 202.1
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

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