CID 131748311

1657031-62-3

Structural Information

Molecular Formula
C18H29ClF3NSn
SMILES
CCCC[Sn](CCCC)(CCCC)C1=C(C=C(C=N1)C(F)(F)F)Cl
InChI
InChI=1S/C6H2ClF3N.3C4H9.Sn/c7-5-1-4(2-11-3-5)6(8,9)10;3*1-3-4-2;/h1-2H;3*1,3-4H2,2H3;
InChIKey
WIPPAIBUBQXBGZ-UHFFFAOYSA-N
Compound name
tributyl-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

471.09625 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 472.10353 209.2
[M+Na]+ 494.08547 215.2
[M-H]- 470.08897 205.5
[M+NH4]+ 489.13007 220.8
[M+K]+ 510.05941 207.6
[M+H-H2O]+ 454.09351 198.5
[M+HCOO]- 516.09445 216.8
[M+CH3COO]- 530.11010 222.3
[M+Na-2H]- 492.07092 207.5
[M]+ 471.09570 211.3
[M]- 471.09680 211.3
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

patents stripe